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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00017643

You can sort the columns by Ligand, Ligand name, PDB and Tanimoto.


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
DGH(2R)-AMINO(4-HYDROXYPHENYL)ACETIC ACIDA,B,C,D,E,F,
G,H,I,J,K,L
1W7Q0.77
DGH(2R)-AMINO(4-HYDROXYPHENYL)ACETIC ACIDA,B,C,D,E,F,
G,H
1W7R0.77
PI7N-[3-(8-SEC-BUTYL-7,10-DIOXO-2-
OXA-6,9-DIAZA-BICYCLO[11.2.2] HEPTADECA-
1(16),13(17),14-TRIEN-11-YAMINO)-
2-HYDROXY-1-(4-HYDROXY-BENZYL) -
PROPYL]-3-METHYL-2-PROPIONYLAMINO-
BUTYRAMIDE
A,B1B6P0.7
OXNOXTOXYNOL-10A1IKT0.7
OXNOXTOXYNOL-10A,B2Q320.7
OXNOXTOXYNOL-10A,B1UEH0.7
OXNOXTOXYNOL-10A,B2D4Q0.7
TTLTRANS-(1S,2S)-2-AMINO-1,2,3,4-TETRAHYDRONAPHTHALEN-
1-OL
A,B2AN50.72
PHLL-PHENYLALANINOLA,B1JOH0.71
PHLL-PHENYLALANINOLI3APR0.71
PHLL-PHENYLALANINOLA1DLZ0.71
PHLL-PHENYLALANINOLA1IH90.71
PHLL-PHENYLALANINOLA1OB40.71
PHLL-PHENYLALANINOLI2ER60.71
PHLL-PHENYLALANINOLA1R9U0.71
PHLL-PHENYLALANINOLA1OB70.71
PHLL-PHENYLALANINOLA,B1OB60.71
PHLL-PHENYLALANINOLA,B,C1AMT0.71
505(2R)-1-(2,6-dimethylphenoxy)propan-
2-amine
A2VIN0.78
REN(S)-reticulineA3FWA0.72
REN(S)-reticulineA3D2D0.72
ZHZ2-(4-METHOXYPHENYL)ACETAMIDED,H2HKR0.78
B3Y(3S)-3-AMINO-4-(4-HYDROXYPHENYL)BUTANOIC ACIDA3HF00.75
B3Y(3S)-3-AMINO-4-(4-HYDROXYPHENYL)BUTANOIC ACIDA2OXK0.75
B3Y(3S)-3-AMINO-4-(4-HYDROXYPHENYL)BUTANOIC ACIDA,B,C2OXJ0.75
PTHCE1-METHYLENE-HYDROXY-PHOSPHOTYROSINEC,D1A090.71
PTHCE1-METHYLENE-HYDROXY-PHOSPHOTYROSINEC,D1A1A0.71
PDH(2S)-2-AMINO-3-PHENYL-1-PROPANOLA1GQ00.71
CTX(Z)-2-[4-(1,2)-DIPHENYL-1-BUTENYL)-
PHENOXY]-N,N-DIMETHYLETHANAMINE
A,B,C1YA40.71
LDPL-DOPAMINEA,B2A3R0.77
LDPL-DOPAMINEA5PAH0.77
LDPL-DOPAMINEA,B2QMZ0.77
LDPL-DOPAMINEA,B2VQ50.77
4BR2-(4-METHYLPHENOXY)ETHYLPHOSPHINATEA1PE70.7
MCM7-AMINO-4-METHYL-CHROMEN-2-ONEA,B,C,D,I,J,
K,L
3EWF0.72
MCM7-AMINO-4-METHYL-CHROMEN-2-ONEA,B,I,L2V5W0.72
MCM7-AMINO-4-METHYL-CHROMEN-2-ONEB1VDN0.72
MCM7-AMINO-4-METHYL-CHROMEN-2-ONEC1VAI0.72
MTYMETA-TYROSINEA2TOH0.74
MTYMETA-TYROSINEA,B1BIQ0.74
MTYMETA-TYROSINEA1Q7O0.74
PTRO-PHOSPHOTYROSINEP1AYC0.72
PTRO-PHOSPHOTYROSINEB1G1F0.72
PTRO-PHOSPHOTYROSINEA,C2CJM0.72
PTRO-PHOSPHOTYROSINEA2PVF0.72
PTRO-PHOSPHOTYROSINEA,B1KC20.72
PTRO-PHOSPHOTYROSINEA2CJZ0.72
PTRO-PHOSPHOTYROSINEA,B2HMH0.72
PTRO-PHOSPHOTYROSINEB1SHB0.72
PTRO-PHOSPHOTYROSINEA,B,C,D1K4S0.72
PTRO-PHOSPHOTYROSINEA,B3DK70.72
PTRO-PHOSPHOTYROSINEB,D,P2HWL0.72
PTRO-PHOSPHOTYROSINEA,B2W1I0.72
PTRO-PHOSPHOTYROSINEA,B1P7D0.72
PTRO-PHOSPHOTYROSINEE,I1ZFP0.72
PTRO-PHOSPHOTYROSINEA,B3BU60.72
PTRO-PHOSPHOTYROSINEC,D1A070.72
PTRO-PHOSPHOTYROSINEA3BU30.72
PTRO-PHOSPHOTYROSINEA,B2V7A0.72
PTRO-PHOSPHOTYROSINEB1CSY0.72
PTRO-PHOSPHOTYROSINEA3LCK0.72
PTRO-PHOSPHOTYROSINEI1TZE0.72
PTRO-PHOSPHOTYROSINEB1I3Z0.72
PTRO-PHOSPHOTYROSINEA,G3CI50.72
PTRO-PHOSPHOTYROSINEA,B1YVH0.72
PTRO-PHOSPHOTYROSINEA,B2HCK0.72
PTRO-PHOSPHOTYROSINEA3BUN0.72
PTRO-PHOSPHOTYROSINEA,B2B7A0.72
PTRO-PHOSPHOTYROSINEA,B1GNG0.72
PTRO-PHOSPHOTYROSINEA,B2OQ10.72
PTRO-PHOSPHOTYROSINEA1IR30.72
PTRO-PHOSPHOTYROSINEB1CSZ0.72
PTRO-PHOSPHOTYROSINEB1PTT0.72
PTRO-PHOSPHOTYROSINEB1KA60.72
PTRO-PHOSPHOTYROSINEC,D1A1C0.72
PTRO-PHOSPHOTYROSINEB1LKL0.72
PTRO-PHOSPHOTYROSINEA1UUS0.72
PTRO-PHOSPHOTYROSINEA,B1AD50.72
PTRO-PHOSPHOTYROSINEA1O9U0.72
PTRO-PHOSPHOTYROSINEA,B3DK60.72
PTRO-PHOSPHOTYROSINEA,B2I6O0.72
PTRO-PHOSPHOTYROSINEA1PTY0.72
PTRO-PHOSPHOTYROSINEA,B1TRN0.72
PTRO-PHOSPHOTYROSINEB1M0V0.72
PTRO-PHOSPHOTYROSINEB2G350.72
PTRO-PHOSPHOTYROSINEA,B3D420.72
PTRO-PHOSPHOTYROSINEA,B2C0T0.72
PTRO-PHOSPHOTYROSINEA,B2CBL0.72
PTRO-PHOSPHOTYROSINEA1KSW0.72
PTRO-PHOSPHOTYROSINEA,B2OW30.72
PTRO-PHOSPHOTYROSINEB1PTU0.72
PTRO-PHOSPHOTYROSINEA2ZM10.72
PTRO-PHOSPHOTYROSINEB,C2H5K0.72
PTRO-PHOSPHOTYROSINEA,B1PKG0.72
PTRO-PHOSPHOTYROSINEA3C7Q0.72
PTRO-PHOSPHOTYROSINEB2H7D0.72
PTRO-PHOSPHOTYROSINEP,Q1AYA0.72
PTRO-PHOSPHOTYROSINEA2ZYB0.72
PTRO-PHOSPHOTYROSINEL,M2CI90.72
PTRO-PHOSPHOTYROSINEI1BMB0.72
PTRO-PHOSPHOTYROSINEP1AOT0.72
PTRO-PHOSPHOTYROSINEA2ERK0.72
PTRO-PHOSPHOTYROSINEB2IUH0.72
PTRO-PHOSPHOTYROSINEB1G1H0.72
PTRO-PHOSPHOTYROSINEA,B3FUP0.72
PTRO-PHOSPHOTYROSINEL1JYR0.72
PTRO-PHOSPHOTYROSINEA3CLY0.72
PTRO-PHOSPHOTYROSINEA2AUH0.72
PTRO-PHOSPHOTYROSINEA,B,C,D,E,F,
G,H
1R1P0.72
PTRO-PHOSPHOTYROSINEA,C,D1T8I0.72
PTRO-PHOSPHOTYROSINEX2H7F0.72
PTRO-PHOSPHOTYROSINEA2ZM40.72
PTRO-PHOSPHOTYROSINEG,H,I,J,K,L2HDX0.72
PTRO-PHOSPHOTYROSINEA1QPJ0.72
PTRO-PHOSPHOTYROSINEA,B2EU00.72
PTRO-PHOSPHOTYROSINEA,C1NZV0.72
PTRO-PHOSPHOTYROSINEA,B,C,D2B4S0.72
PTRO-PHOSPHOTYROSINEB2PLD0.72
PTRO-PHOSPHOTYROSINEC,D,E,F1XXP0.72
PTRO-PHOSPHOTYROSINEA2QOQ0.72
PTRO-PHOSPHOTYROSINEA1HCT0.72
PTRO-PHOSPHOTYROSINEA,B,C,D2ZM30.72
PTRO-PHOSPHOTYROSINEB1LKK0.72
PTRO-PHOSPHOTYROSINEA,B,C,D1YVL0.72
PTRO-PHOSPHOTYROSINEB2Z8P0.72
PTRO-PHOSPHOTYROSINEA1UUR0.72
PTRO-PHOSPHOTYROSINEB,D,F,H,J,L1A810.72
PTRO-PHOSPHOTYROSINEB1LCK0.72
PTRO-PHOSPHOTYROSINEA2QO70.72
PTRO-PHOSPHOTYROSINEB1FPR0.72
PTRO-PHOSPHOTYROSINEA3BUM0.72
PTRO-PHOSPHOTYROSINEB2FCI0.72
PTRO-PHOSPHOTYROSINEA2QYQ0.72
PTRO-PHOSPHOTYROSINEA3BYM0.72
PTRO-PHOSPHOTYROSINEA2OH40.72
PTRO-PHOSPHOTYROSINEB1G1G0.72
PTRO-PHOSPHOTYROSINEB1SHC0.72
PTRO-PHOSPHOTYROSINEA1BF50.72
PTRO-PHOSPHOTYROSINEH,L1JYQ0.72
PTRO-PHOSPHOTYROSINEA2Z8C0.72
PTRO-PHOSPHOTYROSINEA,B1CM80.72
PTRO-PHOSPHOTYROSINEB,D3DA90.72
PTRO-PHOSPHOTYROSINEA,L2CIA0.72
PTRO-PHOSPHOTYROSINEX2DQ70.72
PTRO-PHOSPHOTYROSINEA,P2VIF0.72
PTRO-PHOSPHOTYROSINEB1F1W0.72
PTRO-PHOSPHOTYROSINED,E,F1SPS0.72
PTRO-PHOSPHOTYROSINEA,B2C0I0.72
PTRO-PHOSPHOTYROSINEB1OO40.72
PTRO-PHOSPHOTYROSINEA,C,D1A310.72
PTRO-PHOSPHOTYROSINEA,B,C,D,E,F,
G,H
1R1S0.72
PTRO-PHOSPHOTYROSINEA,B,C,D1NH30.72
PTRO-PHOSPHOTYROSINEB1TCE0.72
PTRO-PHOSPHOTYROSINEA,B2ETZ0.72
PTRO-PHOSPHOTYROSINEC,D1A1B0.72
PTRO-PHOSPHOTYROSINEA,B1FBV0.72
PTRO-PHOSPHOTYROSINEA1QCF0.72
PTRO-PHOSPHOTYROSINEA,B3F880.72
PTRO-PHOSPHOTYROSINEA2PTK0.72
PTRO-PHOSPHOTYROSINEA1QPD0.72
PTRO-PHOSPHOTYROSINEA,B1RRJ0.72
PTRO-PHOSPHOTYROSINEA,C,D1K4T0.72
PTRO-PHOSPHOTYROSINEA1YWN0.72
PTRO-PHOSPHOTYROSINEA,B,C,D1R1Q0.72
PTRO-PHOSPHOTYROSINEA,B,E,F1RQQ0.72
PTRO-PHOSPHOTYROSINEA3EYH0.72
PTRO-PHOSPHOTYROSINEA,B,C,D2VX30.72
PTRO-PHOSPHOTYROSINEA,B1YRK0.72
PTRO-PHOSPHOTYROSINEP1AYB0.72
PTRO-PHOSPHOTYROSINEC,D1D4W0.72
PTRO-PHOSPHOTYROSINEA1YVJ0.72
PTRO-PHOSPHOTYROSINEA,B2GQG0.72
PTRO-PHOSPHOTYROSINEA1PTV0.72
PTRO-PHOSPHOTYROSINEB1FU50.72
PTRO-PHOSPHOTYROSINEA1BG10.72
PTRO-PHOSPHOTYROSINEA2IVT0.72
PTRO-PHOSPHOTYROSINEP1J4K0.72
PTRO-PHOSPHOTYROSINEP1AOU0.72
PTRO-PHOSPHOTYROSINEA,C,D1TL80.72
PTRO-PHOSPHOTYROSINEA2DVJ0.72
PTRO-PHOSPHOTYROSINEA,B2J170.72
PTRO-PHOSPHOTYROSINEA,C3BUW0.72
PTRO-PHOSPHOTYROSINEB2PLE0.72
PTRO-PHOSPHOTYROSINEB2BBU0.72
PTRO-PHOSPHOTYROSINEC,D1M6X0.72
PTRO-PHOSPHOTYROSINEA,C1RR80.72
PTRO-PHOSPHOTYROSINEA2J0L0.72
PTRO-PHOSPHOTYROSINEB1JU50.72
PTRO-PHOSPHOTYROSINEA2H8H0.72
PTRO-PHOSPHOTYROSINEB2NMB0.72
PTRO-PHOSPHOTYROSINEC,D,H1P4E0.72
PTRO-PHOSPHOTYROSINEA,B1Z1B0.72
PTRO-PHOSPHOTYROSINEA3BU50.72
PTRO-PHOSPHOTYROSINEI1QG10.72
PTRO-PHOSPHOTYROSINEA,C1SC70.72
PTRO-PHOSPHOTYROSINEA3E620.72
PTRO-PHOSPHOTYROSINEA,C3BUX0.72
PTRO-PHOSPHOTYROSINEB2DXP0.72
PTRO-PHOSPHOTYROSINEB2Q8Y0.72
PTRO-PHOSPHOTYROSINEA,C1NZL0.72
PTRO-PHOSPHOTYROSINEA,B,C,D1YGU0.72
PTRO-PHOSPHOTYROSINEA2IVU0.72
PTRO-PHOSPHOTYROSINEA,B1U540.72
PTRO-PHOSPHOTYROSINEA,B,C,D1P130.72
PTRO-PHOSPHOTYROSINEI,J,K,L1FYR0.72
PTRO-PHOSPHOTYROSINEA,C,D1SEU0.72
PTRO-PHOSPHOTYROSINEB1SHD0.72
PTRO-PHOSPHOTYROSINEA,B3CD30.72
PTRO-PHOSPHOTYROSINEA2QOB0.72
PTRO-PHOSPHOTYROSINEB2H7E0.72
PTRO-PHOSPHOTYROSINEB1PIC0.72
PTRO-PHOSPHOTYROSINEA3EYG0.72
PTRO-PHOSPHOTYROSINEA1FMK0.72
PTRO-PHOSPHOTYROSINEA3E630.72
PTRO-PHOSPHOTYROSINEC,D1A1E0.72
PTRO-PHOSPHOTYROSINEA1QPC0.72
PTRO-PHOSPHOTYROSINEP1FHR0.72
PTRO-PHOSPHOTYROSINEB1H9O0.72
PTRO-PHOSPHOTYROSINEA,B1GAG0.72
PTRO-PHOSPHOTYROSINEB2YU70.72
PTRO-PHOSPHOTYROSINEA1HCS0.72
PTRO-PHOSPHOTYROSINEA,B,C,D3DQW0.72
PTRO-PHOSPHOTYROSINEA3BYO0.72
PTRO-PHOSPHOTYROSINEA,B1EEO0.72
PTRO-PHOSPHOTYROSINEC,D2IUI0.72
PTRO-PHOSPHOTYROSINEA,B,C,D1YGR0.72
PTRO-PHOSPHOTYROSINEB2RMX0.72
PTRO-PHOSPHOTYROSINEA,B3F7Z0.72
PTRO-PHOSPHOTYROSINEB1LCJ0.72
PTRO-PHOSPHOTYROSINEA3E640.72
PTRO-PHOSPHOTYROSINEL1BM20.72
PTRO-PHOSPHOTYROSINEB2ROR0.72
PTRO-PHOSPHOTYROSINEA,C3EB00.72
PTRO-PHOSPHOTYROSINEA2SRC0.72
PTRO-PHOSPHOTYROSINEA,B1EEN0.72
PTRO-PHOSPHOTYROSINEB1SHA0.72
PTRO-PHOSPHOTYROSINEA,B1YI60.72
PTRO-PHOSPHOTYROSINEP1K2M0.72
PTRO-PHOSPHOTYROSINEA2IVV0.72
PTRO-PHOSPHOTYROSINEB1IRS0.72
PTRO-PHOSPHOTYROSINEA,B,C,D,E,F,
G,H,I,J,K,L,
M,R,S,T
3F5P0.72
PTRO-PHOSPHOTYROSINEA,B2ZOQ0.72
PTRO-PHOSPHOTYROSINEA,C3BUO0.72
PTRO-PHOSPHOTYROSINEA2QON0.72
PTRO-PHOSPHOTYROSINEA,B3FXX0.72
PTRO-PHOSPHOTYROSINEA1QPE0.72
PTRO-PHOSPHOTYROSINEB1MW40.72
PTRO-PHOSPHOTYROSINED1J4X0.72
PTRO-PHOSPHOTYROSINEA1K3A0.72
PTRO-PHOSPHOTYROSINEA,B2C0O0.72
PTRO-PHOSPHOTYROSINEA,B,C,D,E,F,
I,J,K,L,M,N
1X270.72
PTRO-PHOSPHOTYROSINEA,B3D440.72
PTRO-PHOSPHOTYROSINEA,B1Z190.72
PTRO-PHOSPHOTYROSINEA2OFU0.72
SFX(3S)-N-methyl-3-phenyl-3-[4-(trifluoromethyl)phenoxy]propan-
1-amine
A3GWW0.77
HV8BENZYL-2-AMINO-PARAMETHOXY-BENZYLSTATINEC1A8G0.74
STH2-AMINO-4H-1,3-BENZOXATHIIN-4-OLA,B,C,D1XKL0.72
BHP(S)-5-(4-BENZYLOXY-PHENYL)-4-(7-
PHENYL-HEPTANOYLAMINO)-PENTANOIC ACID
A,B1J1A0.71
C4MN-[(2R,3S)-3-AMINO-2-HYDROXY-4-
PHENYLBUTYL]-4-METHOXY-2,3,6-TRIMETHYLBENZENESULFONAMIDE
B,I2C930.73
AEG4-[(2R)-2-aminopropyl]phenolA3BUF0.82
YOF3-FLUOROTYROSINEA,B1XIL0.73
YOF3-FLUOROTYROSINEA,B1XDC0.73
YOF3-FLUOROTYROSINEA1RRX0.73
YOF3-FLUOROTYROSINEA,B3FYG0.73
TON2-{2-[4-(1,1,3,3-TETRAMETHYLBUTYL)PHENOXY]ETHOXY}ETHANOLA,B1SEZ0.73
AHT4-(2,5-DIAMINO-5-HYDROXY-PENTYL)-
PHENOL
I,T1TMB0.81
TY33-HYDROXY-L-TYROSINEA,B2VH30.71
HPHPHENYLALANINDIOLI1E5O0.7
HPHPHENYLALANINDIOLA,B1ODX0.7
HPHPHENYLALANINDIOLA,B1MTB0.7
HPHPHENYLALANINDIOLA,B2FGV0.7
HPHPHENYLALANINDIOLA1ODW0.7
HPHPHENYLALANINDIOLA,B2FGU0.7
HPHPHENYLALANINDIOLA,B1HXB0.7
ALEL-EPINEPHRINEA3PAH0.73
ALEL-EPINEPHRINEA2HKK0.73
RFX(3R)-N-methyl-3-phenyl-3-[4-(trifluoromethyl)phenoxy]propan-
1-amine
A3GWV0.77
4HL4-(HYDRAZINOMETHYL)PHENOLA,B2E2U0.75
AEF4-(2-aminoethyl)phenolA3BRA0.79
CMZ(2S)-1-(2,5-dimethylphenoxy)-3-
morpholin-4-ylpropan-2-ol
A2OF00.7
MR11-(1,3-BENZODIOXOL-5-YL)METHANAMINEA2ORQ0.77
T443,5,3',5'-TETRAIODO-L-THYRONINEX1Y0X0.72
T443,5,3',5'-TETRAIODO-L-THYRONINEA1HK10.72
T443,5,3',5'-TETRAIODO-L-THYRONINEC,D1ICT0.72
T443,5,3',5'-TETRAIODO-L-THYRONINEA2RIW0.72
T443,5,3',5'-TETRAIODO-L-THYRONINEA,B2ROX0.72
T443,5,3',5'-TETRAIODO-L-THYRONINEA,B1IE40.72
T443,5,3',5'-TETRAIODO-L-THYRONINE1,21ETB0.72
T443,5,3',5'-TETRAIODO-L-THYRONINE1,21ETA0.72
T443,5,3',5'-TETRAIODO-L-THYRONINEA,B,C1SN00.72
T443,5,3',5'-TETRAIODO-L-THYRONINEA,B2CEO0.72
T443,5,3',5'-TETRAIODO-L-THYRONINEA,B1F860.72
T443,5,3',5'-TETRAIODO-L-THYRONINEA1HK40.72
T443,5,3',5'-TETRAIODO-L-THYRONINEA1HK20.72
T443,5,3',5'-TETRAIODO-L-THYRONINEA1HK50.72
T443,5,3',5'-TETRAIODO-L-THYRONINEA1HK30.72
CTLCIS-(1R,2S)-2-AMINO-1,2,3,4-TETRAHYDRONAPHTHALEN-
1-OL
A,B2AN30.72
OHT4-HYDROXYTAMOXIFENA3ERT0.73
OHT4-HYDROXYTAMOXIFENA,B1S9Q0.73
OHT4-HYDROXYTAMOXIFENA,B1VJB0.73
OHT4-HYDROXYTAMOXIFENA,B,C,P,R2JF90.73
OHT4-HYDROXYTAMOXIFENA,B,C,D,E,F2GPV0.73
OHT4-HYDROXYTAMOXIFENA2GPU0.73
OHT4-HYDROXYTAMOXIFENA2P7Z0.73
OHT4-HYDROXYTAMOXIFENA,B2BJ40.73
OHT4-HYDROXYTAMOXIFENA,B2FSZ0.73
PS03(S)-AMINO-4-PHENYL-BUTAN-2(S)-
OL
A,B,I1ZSR0.73
PS03(S)-AMINO-4-PHENYL-BUTAN-2(S)-
OL
I1ZJ70.73
PS03(S)-AMINO-4-PHENYL-BUTAN-2(S)-
OL
I1ZLF0.73
PS03(S)-AMINO-4-PHENYL-BUTAN-2(S)-
OL
I1HEG0.73
PS03(S)-AMINO-4-PHENYL-BUTAN-2(S)-
OL
I1FQX0.73
PS03(S)-AMINO-4-PHENYL-BUTAN-2(S)-
OL
A,B,I1IIQ0.73
PS03(S)-AMINO-4-PHENYL-BUTAN-2(S)-
OL
I1HEF0.73
RHP(3R)-3-(PROP-2-YNYLAMINO)INDAN-
5-OL
A,B1S3E0.73
DRS(9S,12S)-9-(1-methylethyl)-7,10-
dioxo-2-oxa-8,11-diazabicyclo[12.2.2]octadeca-
1(16),14,17-triene-12-carboxylic acid
A,B3BXS0.72
AL9N-[(4-METHOXYPHENYL)METHYL]2,5-
THIOPHENEDESULFONAMIDE
A1BN40.71
PZM1-(4-METHOXYPHENYL)METHANAMINEA,D,H2HJB0.88
DRRA,B3BXR0.7
GHP4-HYDROXYPHENYLGLYCINEA1DSR0.77
SGI3-(4-hydroxyphenyl)propanamideA,B2R9K0.71
AEH4-(2-aminoethyl)-2-ethylphenolA3BUG0.78
LNRL-NOREPINEPHRINEA,B2QEO0.76
LNRL-NOREPINEPHRINEA3DYE0.76
LNRL-NOREPINEPHRINEA4PAH0.76
PR03(S)-AMINO-4-PHENYL-BUTAN-2(R)-
OL
A,B,I1ZSF0.73
PR03(S)-AMINO-4-PHENYL-BUTAN-2(R)-
OL
A1JLD0.73
PR03(S)-AMINO-4-PHENYL-BUTAN-2(R)-
OL
A,B1IDA0.73
PR03(S)-AMINO-4-PHENYL-BUTAN-2(R)-
OL
A,B1IDB0.73
PR03(S)-AMINO-4-PHENYL-BUTAN-2(R)-
OL
A,B,I1Z8C0.73
PR03(S)-AMINO-4-PHENYL-BUTAN-2(R)-
OL
A,B,I1ZBG0.73
PR03(S)-AMINO-4-PHENYL-BUTAN-2(R)-
OL
A,B,I1ZPK0.73
P14N-[2-(2-{[(4-{[AMINO(IMINO)METHYL]AMINO}BUTYL)AMINO]METHYL}-
4-METHOXYPHENOXY)ETHYL]GUANIDINE
B1UUD0.72
DID4,4'[1,6-HEXANEDIYLBIS(OXY)]BISBENZENECARBOXIMIDAMIDEA,B,C,D1RPW0.74
PET1,5-DI(4-AMIDINOPHENOXY)-3-OXA-
PENTANE
B166D0.73
EGC2-(2-{2-[2-(2-{2-[2-(2-{2-[4-(1,1,3,3-
TETRAMETHYL-BUTYL)-PHENOXY]-ETHOXY}-
ETHOXY)-ETHOXY]-ETHOXY}-ETHOXY)-
ETHOXY]-ETHOXY}-ETHOXY)-ETHANOL
A,B1JP30.7
EGC2-(2-{2-[2-(2-{2-[2-(2-{2-[4-(1,1,3,3-
TETRAMETHYL-BUTYL)-PHENOXY]-ETHOXY}-
ETHOXY)-ETHOXY]-ETHOXY}-ETHOXY)-
ETHOXY]-ETHOXY}-ETHOXY)-ETHANOL
A2W220.7
HA26-[{(2S)-2-AMINO-3-[4-(BENZYLOXY)PHENYL]PROPYL}(HYDROXY)AMINO]-
6-OXOHEXANOIC ACID)
A2VJ80.72
TYSO-SULFO-L-TYROSINEH,I1O2G0.73
TYSO-SULFO-L-TYROSINEI,J1AY60.73
TYSO-SULFO-L-TYROSINEB,I1QHR0.73
TYSO-SULFO-L-TYROSINEB,C1TWX0.73
TYSO-SULFO-L-TYROSINEB,D2K030.73
TYSO-SULFO-L-TYROSINEH,I1YPK0.73
TYSO-SULFO-L-TYROSINEH,I1SB10.73
TYSO-SULFO-L-TYROSINEA,B1ZGV0.73
TYSO-SULFO-L-TYROSINEB,I2C8Y0.73
TYSO-SULFO-L-TYROSINEH,I2ZGB0.73
TYSO-SULFO-L-TYROSINEH,I2ZC90.73
TYSO-SULFO-L-TYROSINED,H2JH60.73
TYSO-SULFO-L-TYROSINEH,I2ZDV0.73
TYSO-SULFO-L-TYROSINEI1VR10.73
TYSO-SULFO-L-TYROSINEA,B,I1DOJ0.73
TYSO-SULFO-L-TYROSINEH,I2BVR0.73
TYSO-SULFO-L-TYROSINEH,I,L1GHY0.73
TYSO-SULFO-L-TYROSINEH,I1T4V0.73
TYSO-SULFO-L-TYROSINEH,I1TOM0.73
TYSO-SULFO-L-TYROSINEH,I1YPE0.73
TYSO-SULFO-L-TYROSINEB,I1WAY0.73
TYSO-SULFO-L-TYROSINE2,31C4Y0.73
TYSO-SULFO-L-TYROSINEH,I2ZHF0.73
TYSO-SULFO-L-TYROSINEB,I2C8Z0.73
TYSO-SULFO-L-TYROSINEH,I1A5G0.73
TYSO-SULFO-L-TYROSINEH,I1YPL0.73
TYSO-SULFO-L-TYROSINEA,B,C,D,E,F,H2QAD0.73
TYSO-SULFO-L-TYROSINEH,I,R1B5G0.73
TYSO-SULFO-L-TYROSINEB,C1MU80.73
TYSO-SULFO-L-TYROSINEA,B1GWB0.73
TYSO-SULFO-L-TYROSINEB,I2C900.73
TYSO-SULFO-L-TYROSINEB,I1WBG0.73
TYSO-SULFO-L-TYROSINEB,I2C930.73
TYSO-SULFO-L-TYROSINEB,C1G300.73
TYSO-SULFO-L-TYROSINEB,H2UUK0.73
TYSO-SULFO-L-TYROSINEH,I3EGK0.73
TYSO-SULFO-L-TYROSINEH,I1C5N0.73
TYSO-SULFO-L-TYROSINEH,I1A610.73
TYSO-SULFO-L-TYROSINEH,I1C5L0.73
TYSO-SULFO-L-TYROSINEA,H1XM10.73
TYSO-SULFO-L-TYROSINEH,I1A2C0.73
TYSO-SULFO-L-TYROSINEH,I2BVX0.73
TYSO-SULFO-L-TYROSINEH,I2ZFF0.73
TYSO-SULFO-L-TYROSINEH,I3BIU0.73
TYSO-SULFO-L-TYROSINEB,H1D3P0.73
TYSO-SULFO-L-TYROSINEB,H1D3Q0.73
TYSO-SULFO-L-TYROSINEH,I2ZFP0.73
TYSO-SULFO-L-TYROSINEB,C,D1BA80.73
TYSO-SULFO-L-TYROSINEA,I1D6W0.73
TYSO-SULFO-L-TYROSINEH,I2ZF00.73
TYSO-SULFO-L-TYROSINEH,I2ZGX0.73
TYSO-SULFO-L-TYROSINEB,G1OOK0.73
TYSO-SULFO-L-TYROSINEH,I1AE80.73
TYSO-SULFO-L-TYROSINEH,I2ZFR0.73
TYSO-SULFO-L-TYROSINEA,H1NT10.73
TYSO-SULFO-L-TYROSINEH,I2ZFQ0.73
TYSO-SULFO-L-TYROSINEE,I1HAG0.73
TYSO-SULFO-L-TYROSINEB,I2C8X0.73
TYSO-SULFO-L-TYROSINEH,I2BXT0.73
TYSO-SULFO-L-TYROSINED,H2GDE0.73
TYSO-SULFO-L-TYROSINEH,I,R1TBZ0.73
TYSO-SULFO-L-TYROSINEH,I1BCU0.73
TYSO-SULFO-L-TYROSINEB,C1KTS0.73
TYSO-SULFO-L-TYROSINEH,I2BXU0.73
TYSO-SULFO-L-TYROSINEB,I1QJ70.73
TYSO-SULFO-L-TYROSINEH,I1K220.73
TYSO-SULFO-L-TYROSINEI,T1TMB0.73
TYSO-SULFO-L-TYROSINEH,I1AHT0.73
TYSO-SULFO-L-TYROSINEI1HGT0.73
TYSO-SULFO-L-TYROSINEB,I1QJ10.73
TYSO-SULFO-L-TYROSINEA,B1TA60.73
TYSO-SULFO-L-TYROSINEH,I1AFE0.73
TYSO-SULFO-L-TYROSINEH,I1AIX0.73
TYSO-SULFO-L-TYROSINEH,I2ZG00.73
TYSO-SULFO-L-TYROSINEC,D2PKS0.73
TYSO-SULFO-L-TYROSINEB,C1MUE0.73
TYSO-SULFO-L-TYROSINED,H2JH50.73
TYSO-SULFO-L-TYROSINEB,D2K050.73
TYSO-SULFO-L-TYROSINEB,C1MU60.73
TYSO-SULFO-L-TYROSINEA,B,C,D1G1S0.73
TYSO-SULFO-L-TYROSINEH,I1HAH0.73
TYSO-SULFO-L-TYROSINEH,I2ZI20.73
TYSO-SULFO-L-TYROSINEH,I3BIV0.73
TYSO-SULFO-L-TYROSINE2,31C4U0.73
TYSO-SULFO-L-TYROSINEA,B1NM60.73
TYSO-SULFO-L-TYROSINEA,B3C1K0.73
TYSO-SULFO-L-TYROSINEA,I1D9I0.73
TYSO-SULFO-L-TYROSINEH,I1YPG0.73
TYSO-SULFO-L-TYROSINEB,H1D4P0.73
TYSO-SULFO-L-TYROSINEH,I,J1TMU0.73
TYSO-SULFO-L-TYROSINEH,I1YPM0.73
TYSO-SULFO-L-TYROSINEB,C1BB00.73
TYSO-SULFO-L-TYROSINEA,C1P8V0.73
TYSO-SULFO-L-TYROSINEB,H2UUF0.73
TYSO-SULFO-L-TYROSINEB,C1G320.73
TYSO-SULFO-L-TYROSINEH,I1YPJ0.73
TYSO-SULFO-L-TYROSINEB,I2C8W0.73
TYSO-SULFO-L-TYROSINEI,K1H8D0.73
TYSO-SULFO-L-TYROSINEH,I1GJ40.73
TYSO-SULFO-L-TYROSINEH,I1O5G0.73
TYSO-SULFO-L-TYROSINEA2RLL0.73
TYSO-SULFO-L-TYROSINEH,I1AD80.73
TYSO-SULFO-L-TYROSINEH,I1C1U0.73
TYSO-SULFO-L-TYROSINEH,I,L1GHX0.73
TYSO-SULFO-L-TYROSINEA,B1ZRB0.73
TYSO-SULFO-L-TYROSINEA,B2BDY0.73
TYSO-SULFO-L-TYROSINEH,I2ZHE0.73
TYSO-SULFO-L-TYROSINED,H2JH00.73
TYSO-SULFO-L-TYROSINEA,B1TA20.73
TYSO-SULFO-L-TYROSINEB,H2UUJ0.73
TYSO-SULFO-L-TYROSINEA,H1JMO0.73
TYSO-SULFO-L-TYROSINEA,B1SL30.73
TYSO-SULFO-L-TYROSINEH,I2ZHQ0.73
TYSO-SULFO-L-TYROSINEH,I2ZO30.73
TYSO-SULFO-L-TYROSINE2,3,48KME0.73
TYSO-SULFO-L-TYROSINEH,I,L1C1W0.73
TYSO-SULFO-L-TYROSINEB,I1QJ60.73
TYSO-SULFO-L-TYROSINEA,B1Z710.73
TYSO-SULFO-L-TYROSINEA,B1ZGI0.73
TYSO-SULFO-L-TYROSINEH,I1C5O0.73
TYSO-SULFO-L-TYROSINEI,T3HAT0.73
TYSO-SULFO-L-TYROSINEH,I3DUX0.73
TYSO-SULFO-L-TYROSINEH,I1C1V0.73
TYSO-SULFO-L-TYROSINEH,I2ZNK0.73
TYSO-SULFO-L-TYROSINEH,I3D490.73
TYSO-SULFO-L-TYROSINEH,I1GJ50.73
TYSO-SULFO-L-TYROSINEH,I1UMA0.73
TYSO-SULFO-L-TYROSINEH,I3DT00.73
TYSO-SULFO-L-TYROSINEE,H1QBV0.73
TYSO-SULFO-L-TYROSINEI,K1H8I0.73
TYSO-SULFO-L-TYROSINEA,C,D1RZG0.73
TYSO-SULFO-L-TYROSINEH,I1AI80.73
TYSO-SULFO-L-TYROSINEH,I,J7KME0.73
TYSO-SULFO-L-TYROSINEH,I,L2PW80.73
TYSO-SULFO-L-TYROSINEH,I1A4W0.73
TYSO-SULFO-L-TYROSINEH,I1GHV0.73
TYSO-SULFO-L-TYROSINEH,I1NO90.73
TYSO-SULFO-L-TYROSINEH,I1AWF0.73
TYSO-SULFO-L-TYROSINEH,I1K210.73
TYSO-SULFO-L-TYROSINEH,I1T4U0.73
TYSO-SULFO-L-TYROSINEB,H1D3D0.73
TYSO-SULFO-L-TYROSINEB,H1D3T0.73
TYSO-SULFO-L-TYROSINEH,I1A460.73
TYSO-SULFO-L-TYROSINEH,I2ZDA0.73
TYSO-SULFO-L-TYROSINEH,I2ZHW0.73
TYSO-SULFO-L-TYROSINEB2K3U0.73
TYSO-SULFO-L-TYROSINEH,I3DHK0.73
TYSO-SULFO-L-TYROSINEB,C1KTT0.73
TYSO-SULFO-L-TYROSINEH,I2BVS0.73
TYSO-SULFO-L-TYROSINE31NY20.73
TYSO-SULFO-L-TYROSINEB,C1CA80.73
TYSO-SULFO-L-TYROSINEH,I1GHW0.73
TYSO-SULFO-L-TYROSINE2,31C4V0.73
TYSO-SULFO-L-TYROSINEH,I2ZIQ0.73
TNT1,3-BIS(AMIDINOPHENOXY)PROPANEB102D0.73
TNT1,3-BIS(AMIDINOPHENOXY)PROPANEA1PRP0.73
3MB3-METHOXYBENZAMIDEA3PAX0.72
2TN2-(4-(2-HYDROXY-3-(ISOPROPYLAMINO)PROPOXY)PHENYL)ETHANAMIDEA2OTF0.76
2TN2-(4-(2-HYDROXY-3-(ISOPROPYLAMINO)PROPOXY)PHENYL)ETHANAMIDEA2NUV0.76
2TN2-(4-(2-HYDROXY-3-(ISOPROPYLAMINO)PROPOXY)PHENYL)ETHANAMIDEA2OUB0.76
SNP1-(ISOPROPYLAMINO)-3-(1-NAPHTHYLOXY)-
2-PROPANOL
A1DY40.73
TYBTYROSINALA,B1KDZ0.77
TYBTYROSINALA1Q110.77
TYBTYROSINALA,B2J5B0.77
TYBTYROSINALA,I1GA40.77
TYBTYROSINALA,B,C1NLU0.77
TYBTYROSINALA,B1KE10.77
TYBTYROSINALA,B1H3F0.77
TYBTYROSINALA,B1H3E0.77
D4P(2S)-AMINO(4-HYDROXYPHENYL)ACETIC ACIDA1DSR0.77
D4P(2S)-AMINO(4-HYDROXYPHENYL)ACETIC ACIDA,B,C,D,E,F,
G,H
1W7R0.77
D4P(2S)-AMINO(4-HYDROXYPHENYL)ACETIC ACIDA,B,C,D,E,F,
G,H,I,J,K,L
1W7Q0.77
TYCL-TYROSINAMIDEA2BF90.74
TYCL-TYROSINAMIDEA2OCI0.74
RM24-HYDROXY-N-PROPARGYL-1(R)-AMINOINDANA,B2C660.7
OTS4-(2S-AMINO-1-HYDROXYETHYL)PHENOLA,B1RG20.8
OTS4-(2S-AMINO-1-HYDROXYETHYL)PHENOLA,B1RG10.8
OTS4-(2S-AMINO-1-HYDROXYETHYL)PHENOLA,B1RH00.8
OTS4-(2S-AMINO-1-HYDROXYETHYL)PHENOLA,B1RGU0.8
OTS4-(2S-AMINO-1-HYDROXYETHYL)PHENOLA,B1RGT0.8
SAF3-[(1S)-1-(DIMETHYLAMINO)ETHYL]PHENOLA1GQR0.75
SAF3-[(1S)-1-(DIMETHYLAMINO)ETHYL]PHENOLA1GQS0.75
DPDA,B1QIW0.74
DPDA1QIV0.74
MTJN,O-DIMETHYL-L-TYROSINEA,B1ATL0.8
247(3R)-3-amino-2,2-difluoro-3-(4-
hydroxyphenyl)propanoic acid
A,B2QVE0.77
IYR3-IODO-TYROSINEA2D980.73
IYR3-IODO-TYROSINEA2D8P0.73
IYR3-IODO-TYROSINEA,B3GFD0.73
IYR3-IODO-TYROSINEA2R1Q0.73
IYR3-IODO-TYROSINEA2ZP10.73
IYR3-IODO-TYROSINEA,B,C,D2ZXV0.73
IYR3-IODO-TYROSINEC1CF00.73
IYR3-IODO-TYROSINEA1XXZ0.73
IYR3-IODO-TYROSINEA2D970.73
IYR3-IODO-TYROSINEA1XY90.73
IYR3-IODO-TYROSINEA2Z100.73
IYR3-IODO-TYROSINEA1WQ30.73
IYR3-IODO-TYROSINEA2D8O0.73
IYR3-IODO-TYROSINEA2D8W0.73
IYR3-IODO-TYROSINEA2Z110.73
SEM3-AMINO-4-OXYBENZYL-2-BUTANONEA,B1THE0.7
OTR4-(2R-AMINO-1-HYDROXYETHYL)PHENOLA,B1RGT0.8
OTR4-(2R-AMINO-1-HYDROXYETHYL)PHENOLA,B1RG20.8
OTR4-(2R-AMINO-1-HYDROXYETHYL)PHENOLA,B2AN40.8
P124-[AMINO(IMINO)METHYL]-1-[2-(3-
AMMONIOPROPOXY)-5-METHOXYBENZYL]PIPERAZIN-
1-IUM
B1UUI0.7
TYI3,5-DIIODOTYROSINEA2D8W0.71
TYI3,5-DIIODOTYROSINEE,I1CTP0.71
TYI3,5-DIIODOTYROSINEA2D970.71
TYI3,5-DIIODOTYROSINEA2AXE0.71
TYI3,5-DIIODOTYROSINEA2D8O0.71
TYI3,5-DIIODOTYROSINEA,B2VLW0.71
TYI3,5-DIIODOTYROSINEA,B2C3V0.71
TYI3,5-DIIODOTYROSINEA2D980.71
TYI3,5-DIIODOTYROSINEA2NOO0.71
TYI3,5-DIIODOTYROSINEA2D8P0.71
TYI3,5-DIIODOTYROSINEA,B,C,D,E,F,
G,H
3GH80.71
TYI3,5-DIIODOTYROSINEA,B,C,D1L0S0.71
ANMANISOMYCIN1,2,4,A,B,C,
D,E,J,K,L,M,
N,O,P,R,S,T,
U,V,Z
1K730.78
ANMANISOMYCIN0,1,3,9,A,B,
C,F,H,J,K,L,
M,N,O,Q,R,S,
T,U,Y,Z
3CC40.78
SHP(4-HYDROXYMALTOSEPHENYL)GLYCINEA1DSR0.72
HTAN-[3-(N'-HYDROXYCARBOXAMIDO)-2-
(2-METHYLPROPYL)-PROPANOYL]-O-TYROSINE-
N-METHYLAMIDE
A1FBL0.72
TXF(Z)-4-(1-{4-[2-(DIMETHYLAMINO)ETHOXY]PHENYL}-
5-HYDROXY-2-PHENYLPENT-1-ENYL)PHENOL
A,B,C,D,E2EWP0.73
HV71-METHYLAMINE-2-HYDROXY-4-METHOXY-
BENZENE
C1A8G0.86
DTYD-TYROSINEA1C4B0.74
DTYD-TYROSINEA,L1ZEA0.74
DTYD-TYROSINEA,B,C,D,E,F,
G,H
1OF60.74
DTYD-TYROSINEA,B1UNO0.74
DTYD-TYROSINEA2IGZ0.74
DTYD-TYROSINEA,B,C,H,K,L2R5D0.74
DTYD-TYROSINEA,B2Q330.74
DTYD-TYROSINEH,S2H9E0.74
DTYD-TYROSINEA,B,C,H,K,L2R5B0.74
DTYD-TYROSINEA2IH00.74
DTYD-TYROSINEA1D7T0.74
DTYD-TYROSINEA,B1XA00.74
SLX(13aS)-3,10-dimethoxy-5,8,13,13a-
tetrahydro-6H-isoquino[3,2-a]isoquinoline-
2,9-diol
A3FW90.7
DAH3,4-DIHYDROXYPHENYLALANINEA,B1RNR0.71
DAH3,4-DIHYDROXYPHENYLALANINEA6PAH0.71
DAH3,4-DIHYDROXYPHENYLALANINEA,B1IVV0.71
2AC2-AMINO-P-CRESOLH,I1A2C0.7
2AC2-AMINO-P-CRESOLA1L4M0.7
AED4-(2-aminoethyl)-2-cyclohexylphenolA3BUH0.74
TAX(Z)-2-[4-(1,2)-DIPHENYL-1-BUTENYL)-
PHENOXY]-N,N-DIMETHYLETHANAMINIUM
A1FJ50.73
TA2(2R,3S)-3-AMINO-3-PHENYLPROPANE-
1,2-DIOL
A,B2IFR0.77
EUG2-METHOXY-4-VINYL-PHENOLA2QU90.71
EUG2-METHOXY-4-VINYL-PHENOLA,B1QLU0.71
EUG2-METHOXY-4-VINYL-PHENOLA,B1W1J0.71
EUG2-METHOXY-4-VINYL-PHENOLA,B2VAO0.71
EUG2-METHOXY-4-VINYL-PHENOLA,B1W1K0.71
EUG2-METHOXY-4-VINYL-PHENOLA,B1DZN0.71
EUG2-METHOXY-4-VINYL-PHENOLA,B1W1L0.71
EUG2-METHOXY-4-VINYL-PHENOLA,B1W1M0.71
FLTFLUOROMALONYL TYROSINEI1BZH0.73
T333,3'-DEIODO-THYROXINEA,B1THA0.73
ZHH2-(4-METHOXYPHENYL)ETHANAMINED,H2HKR0.86
PNT1,5-BIS(4-AMIDINOPHENOXY)PENTANEX3CR40.73
PNT1,5-BIS(4-AMIDINOPHENOXY)PENTANEB1D640.73
PNT1,5-BIS(4-AMIDINOPHENOXY)PENTANEX3CR50.73
PNT1,5-BIS(4-AMIDINOPHENOXY)PENTANEA,B,D,E1RKW0.73
296(3R)-3-amino-2,2-difluoro-3-(4-
methoxyphenyl)propanoic acid
A,B2RJS0.86