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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03566922

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
PR03(S)-AMINO-4-PHENYL-BUTAN-2(R)-
OL
A,B,I1ZSF0.72
PR03(S)-AMINO-4-PHENYL-BUTAN-2(R)-
OL
A1JLD0.72
PR03(S)-AMINO-4-PHENYL-BUTAN-2(R)-
OL
A,B1IDA0.72
PR03(S)-AMINO-4-PHENYL-BUTAN-2(R)-
OL
A,B1IDB0.72
PR03(S)-AMINO-4-PHENYL-BUTAN-2(R)-
OL
A,B,I1Z8C0.72
PR03(S)-AMINO-4-PHENYL-BUTAN-2(R)-
OL
A,B,I1ZBG0.72
PR03(S)-AMINO-4-PHENYL-BUTAN-2(R)-
OL
A,B,I1ZPK0.72
HPHPHENYLALANINDIOLI1E5O0.72
HPHPHENYLALANINDIOLA,B1ODX0.72
HPHPHENYLALANINDIOLA,B1MTB0.72
HPHPHENYLALANINDIOLA,B2FGV0.72
HPHPHENYLALANINDIOLA1ODW0.72
HPHPHENYLALANINDIOLA,B2FGU0.72
HPHPHENYLALANINDIOLA,B1HXB0.72
APD3-METHYLPHENYLALANINEA,B,C1GMY0.81
HPQHOMOPHENYLALANINYLMETHANEB1EWP0.73
APMM-AMIDINOPHENYL-3-ALANINEE1PPH0.72
FRFPHE-REDUCED-PHEA,I1GVX0.72
CNTN-METHYL-META-CHLORO-TYROSINEC,D1OKX0.74
PHIIODO-PHENYLALANINEA1TF90.8
PHIIODO-PHENYLALANINEA,B,C,D1ORW0.8
PHIIODO-PHENYLALANINEA1T6H0.8
PHIIODO-PHENYLALANINEA,B,C1NLU0.8
PHIIODO-PHENYLALANINEA,I1GA10.8
PHIIODO-PHENYLALANINEA,I1GA40.8
PHIIODO-PHENYLALANINEP1CZI0.8
PSSETHYLAMINOBENZYLMETHYLCARBONYL GROUPA1EAG0.72
PHK(2R,3S)-3-AMINO-1-CHLORO-4-PHENYL-
BUTAN-2-OL
A1MU00.73
PHK(2R,3S)-3-AMINO-1-CHLORO-4-PHENYL-
BUTAN-2-OL
A1XRL0.73
ALNNAPHTHALEN-2-YL-3-ALANINEA,B,I,J2FIV0.74
ALNNAPHTHALEN-2-YL-3-ALANINEA,B1B0H0.74
ALNNAPHTHALEN-2-YL-3-ALANINEB1FIV0.74
ALNNAPHTHALEN-2-YL-3-ALANINEA,B,I,J3FIV0.74
FOG(4S,5S)-5-amino-4-hydroxy-6-phenylhexanoic acidI1EED0.75
DTYD-TYROSINEA1C4B0.71
DTYD-TYROSINEA,L1ZEA0.71
DTYD-TYROSINEA,B,C,D,E,F,
G,H
1OF60.71
DTYD-TYROSINEA,B1UNO0.71
DTYD-TYROSINEA2IGZ0.71
DTYD-TYROSINEA,B,C,H,K,L2R5D0.71
DTYD-TYROSINEA,B2Q330.71
DTYD-TYROSINEH,S2H9E0.71
DTYD-TYROSINEA,B,C,H,K,L2R5B0.71
DTYD-TYROSINEA2IH00.71
DTYD-TYROSINEA1D7T0.71
DTYD-TYROSINEA,B1XA00.71
SEM3-AMINO-4-OXYBENZYL-2-BUTANONEA,B1THE0.71
MFD(2S,3S,8S,9S)-3-AMINO-9-METHOXY-
2,6,8-TRIMETHYL-10-PHENYLDECA-4,6-
DIENOIC ACID
A1AY30.71
MEAN-METHYLPHENYLALANINEA2PIL0.79
MEAN-METHYLPHENYLALANINEA,B,C,D1H0I0.79
MEAN-METHYLPHENYLALANINEA,B,I1DOJ0.79
BIF(R)-2-AMINO-3-(4-PHENYLCYCLOHEXYL)PROPANOIC ACIDG,M,P,S1YYL0.78
BIF(R)-2-AMINO-3-(4-PHENYLCYCLOHEXYL)PROPANOIC ACIDG,M,P,S2I5Y0.78
CLDD-PARA-CHLOROPHENYL-1-ACTEAMIDOBORONIC ACID ALANINEA1AVT0.75
PS03(S)-AMINO-4-PHENYL-BUTAN-2(S)-
OL
A,B,I1ZSR0.72
PS03(S)-AMINO-4-PHENYL-BUTAN-2(S)-
OL
I1ZJ70.72
PS03(S)-AMINO-4-PHENYL-BUTAN-2(S)-
OL
I1ZLF0.72
PS03(S)-AMINO-4-PHENYL-BUTAN-2(S)-
OL
I1HEG0.72
PS03(S)-AMINO-4-PHENYL-BUTAN-2(S)-
OL
I1FQX0.72
PS03(S)-AMINO-4-PHENYL-BUTAN-2(S)-
OL
A,B,I1IIQ0.72
PS03(S)-AMINO-4-PHENYL-BUTAN-2(S)-
OL
I1HEF0.72
PMEN-L-ALPHA-ASPARTYL L-PHENYLALANINE 1-
METHYL ESTER
H,L1A8J0.71
FE34-(2-aminoethyl)-3-chlorobenzoic acidA,B2K1Q0.76
PG9D-PHENYLGLYCINEA,B,G,H10GS0.77
PG9D-PHENYLGLYCINEA,B,C,D2B4K0.77
LHYL-[(N-HYDROXYAMINO)CARBONYL]PHENYLALANINEA,B,D,E1HEE0.71
PFF4-FLUORO-L-PHENYLALANINEA3F3C0.8
PFF4-FLUORO-L-PHENYLALANINEA,C,E,F2UUE0.8
PFF4-FLUORO-L-PHENYLALANINEA1ZNT0.8
PFF4-FLUORO-L-PHENYLALANINEF,H1OL10.8
PFF4-FLUORO-L-PHENYLALANINEA,C,F,H2C5V0.8
PFF4-FLUORO-L-PHENYLALANINEE,F1OL20.8
MPQN-METHYL-ALPHA-PHENYL-GLYCINED1D6E0.73
CXAPHENYLALANINE-N-SULFONAMIDEA1IY70.78
INGD-[(AMINO)CARBONYL]PHENYLALANINEA,B1UF80.73
INGD-[(AMINO)CARBONYL]PHENYLALANINEA,B,D,E1HDU0.73
IAM4-[(ISOPROPYLAMINO)METHYL]PHENYLALANINEA1XY50.74
IAM4-[(ISOPROPYLAMINO)METHYL]PHENYLALANINEA1XY80.74
IAM4-[(ISOPROPYLAMINO)METHYL]PHENYLALANINEA1XY90.74
IAM4-[(ISOPROPYLAMINO)METHYL]PHENYLALANINEA1XXZ0.74
IAM4-[(ISOPROPYLAMINO)METHYL]PHENYLALANINEA1XY40.74
IAM4-[(ISOPROPYLAMINO)METHYL]PHENYLALANINEA1XY60.74
CHP3-CHLORO-4-HYDROXYPHENYLGLYCINEA1DSR0.73
1PAPHENYLMETHYLACETIC ACID ALANINEI1BHF0.78
SMF4-SULFOMETHYL-L-PHENYLALANINED,H1O0D0.73
SMF4-SULFOMETHYL-L-PHENYLALANINED,H2FES0.73
SMF4-SULFOMETHYL-L-PHENYLALANINEH,P2ANK0.73
SMF4-SULFOMETHYL-L-PHENYLALANINED,H2FEQ0.73
SMF4-SULFOMETHYL-L-PHENYLALANINEH,P2A2X0.73
SMF4-SULFOMETHYL-L-PHENYLALANINED,H1NZQ0.73
2CL(2,6-DICHLOROPHENYL)ACETIC ACIDA2IPW0.71
2CL(2,6-DICHLOROPHENYL)ACETIC ACIDA2IS70.71
FCL3-CHLORO-L-PHENYLALANINEE,F1OKW0.92
1ZN(2S,3S,4E,6E,8S,9S)-3-amino-9-methoxy-
2,6,8-trimethyl-10-phenyldeca-4,6-
dienoic acid
C,F,M,N2IAE0.71
PSA3-HYDROXY-4-AMINO-5-PHENYLPENTANOIC ACIDI1EPL0.77
PSA3-HYDROXY-4-AMINO-5-PHENYLPENTANOIC ACIDA,B,C,D2IFW0.77
PSA3-HYDROXY-4-AMINO-5-PHENYLPENTANOIC ACIDE,I1EPM0.77
ADD2,6,8-TRIMETHYL-3-AMINO-9-BENZYL-
9-METHOXYNONANOIC ACID
A,B,M,N1FJM0.75
ADD2,6,8-TRIMETHYL-3-AMINO-9-BENZYL-
9-METHOXYNONANOIC ACID
A1EVA0.75
ADD2,6,8-TRIMETHYL-3-AMINO-9-BENZYL-
9-METHOXYNONANOIC ACID
A1LCM0.75
ADD2,6,8-TRIMETHYL-3-AMINO-9-BENZYL-
9-METHOXYNONANOIC ACID
A,B,C,D,E,F,
G,H
2NYM0.75
ADD2,6,8-TRIMETHYL-3-AMINO-9-BENZYL-
9-METHOXYNONANOIC ACID
C,I2IE30.75
ADD2,6,8-TRIMETHYL-3-AMINO-9-BENZYL-
9-METHOXYNONANOIC ACID
C,F,X,Y2NPP0.75
ADD2,6,8-TRIMETHYL-3-AMINO-9-BENZYL-
9-METHOXYNONANOIC ACID
A1EVC0.75
ADD2,6,8-TRIMETHYL-3-AMINO-9-BENZYL-
9-METHOXYNONANOIC ACID
C,F,G,H3DW80.75
ADD2,6,8-TRIMETHYL-3-AMINO-9-BENZYL-
9-METHOXYNONANOIC ACID
A,B,C,D,E,F,
G,H
2NYL0.75
ADD2,6,8-TRIMETHYL-3-AMINO-9-BENZYL-
9-METHOXYNONANOIC ACID
A1EVD0.75
ADD2,6,8-TRIMETHYL-3-AMINO-9-BENZYL-
9-METHOXYNONANOIC ACID
A1EVB0.75
PHAPHENYLALANINALA,B1OB20.75
PHAPHENYLALANINALV,Y,Z2WDG0.75
PHAPHENYLALANINALV,Y,Z2WDK0.75
PHAPHENYLALANINAL1,2,4,5,A,B,
C,D,E,J,K,L,
M,N,O,P,R,S,
T,U,V,Z
1M900.75
PHAPHENYLALANINALP3SGA0.75
PHAPHENYLALANINALA,B,C,D,E,F1OB50.75
PHAPHENYLALANINALV,Y,Z2WDM0.75
PHAPHENYLALANINAL0,2,4,9,A,B,
C,H,I,J,K,L,
M,N,P,Q,R,S,
T,X,Y,Z
1KQS0.75
PHAPHENYLALANINALA,B1KDV0.75
PHAPHENYLALANINAL1,2,4,5,6,A,
B,C,D,E,J,K,
L,M,N,O,P,R,
S,T,U,V,Z
1Q860.75
PHAPHENYLALANINALA,B1KDY0.75
PHAPHENYLALANINALV,Y,Z3FIC0.75
PHAPHENYLALANINALV,Y,Z2WDH0.75
PHAPHENYLALANINALA,B1KE20.75
4BF4-BROMO-L-PHENYLALANINEA2AG60.75
4PH4-methyl-L-phenylalanineB,C3BV90.81
4AF4-ACETYL-L-PHENYLALANINEA1ZH60.76
PCSPHENYLALANYLMETHYLCHLORIDEB,D1DLK0.76
PCSPHENYLALANYLMETHYLCHLORIDEA1XQX0.76
NFAPHENYLALANINE AMIDEA,B,C,D2BTJ0.72
NFAPHENYLALANINE AMIDEA,B,C,D,E,F2EFX0.72
NFAPHENYLALANINE AMIDEA,B,C,D2VVJ0.72
NFAPHENYLALANINE AMIDEA2A4O0.72
NFAPHENYLALANINE AMIDEA,B1XAE0.72
NFAPHENYLALANINE AMIDEA,B,C,D2OGR0.72
NFAPHENYLALANINE AMIDEA,B,C,D1QA70.72
NFAPHENYLALANINE AMIDEA,B,C,D2GW40.72
PF52,3,4,5,6-PENTAFLUORO-L-PHENYLALANINEA2JM00.72
PBFPARA-(BENZOYL)-PHENYLALANINEA2FR90.73
PBFPARA-(BENZOYL)-PHENYLALANINEA,B1EEN0.73
PBFPARA-(BENZOYL)-PHENYLALANINEA2HGZ0.73
PBFPARA-(BENZOYL)-PHENYLALANINEA2FRB0.73
INFD-[(N-HYDROXYAMINO)CARBONYL]PHENYLALANINEA1HDQ0.71
HMF2-AMINO-4-PHENYL-BUTYRIC ACIDI,J1AY60.8
CT21-(PHENYLMETHYL)CYCLOPENTYL[(1S)-
1-FORMYLPENTYL]CARBAMATE
A2AUZ0.7
PDH(2S)-2-AMINO-3-PHENYL-1-PROPANOLA1GQ00.72
HPEHOMOPHENYLALANINEA,B1B1H0.8
NALBETA-(2-NAPHTHYL)-ALANINEA,B2ITK0.74
NALBETA-(2-NAPHTHYL)-ALANINEH,I4THN0.74
NALBETA-(2-NAPHTHYL)-ALANINEA,B2Q5A0.74
NALBETA-(2-NAPHTHYL)-ALANINEA1ZWU0.74
NALBETA-(2-NAPHTHYL)-ALANINEA1SKL0.74
NALBETA-(2-NAPHTHYL)-ALANINEH,I5GDS0.74
NALBETA-(2-NAPHTHYL)-ALANINEA1ZH00.74
NALBETA-(2-NAPHTHYL)-ALANINEA,B2JT90.74
PHMPHENYLALANYLMETHANEA,I1PJP0.74
PHMPHENYLALANYLMETHANEA,B,C2J9J0.74
PHMPHENYLALANYLMETHANEA,B,C2JE40.74
APHP-AMIDINOPHENYL-3-ALANINEE,I1PPC0.72
APHP-AMIDINOPHENYL-3-ALANINEH1ETS0.72
APHP-AMIDINOPHENYL-3-ALANINEH1ETT0.72
APHP-AMIDINOPHENYL-3-ALANINEI1QUR0.72
PHLL-PHENYLALANINOLA,B1JOH0.72
PHLL-PHENYLALANINOLI3APR0.72
PHLL-PHENYLALANINOLA1DLZ0.72
PHLL-PHENYLALANINOLA1IH90.72
PHLL-PHENYLALANINOLA1OB40.72
PHLL-PHENYLALANINOLI2ER60.72
PHLL-PHENYLALANINOLA1R9U0.72
PHLL-PHENYLALANINOLA1OB70.72
PHLL-PHENYLALANINOLA,B1OB60.72
PHLL-PHENYLALANINOLA,B,C1AMT0.72
CS4S-[3-(3,4-DICHLOROPHENYL)-3-OXOPROPYL]-
L-CYSTEINE
A2OQZ0.7
FTYDEOXY-DIFLUOROMETHELENE-PHOSPHOTYROSINEC,D1A080.73
FTYDEOXY-DIFLUOROMETHELENE-PHOSPHOTYROSINEC,D,E,F1QZ00.73
FTYDEOXY-DIFLUOROMETHELENE-PHOSPHOTYROSINEC,D,E,F1XXV0.73
CT1(1R)-2-METHYL-1-(PHENYLMETHYL)PROPYL[(1S)-
1-FORMYLPENTYL]CARBAMATE
A2AUX0.71
CLBD-PARA-CHLOROPHENYL-1-ACETAMIDOBORONIC ACID ALANINEA1VSB0.75
DPND-PHENYLALANINEP1MCS0.82
DPND-PHENYLALANINEA1GOE0.82
DPND-PHENYLALANINEA2RM90.82
DPND-PHENYLALANINEA1SOC0.82
DPND-PHENYLALANINEB,C,E,F1SFQ0.82
DPND-PHENYLALANINEI1ABJ0.82
DPND-PHENYLALANINEP1DWE0.82
DPND-PHENYLALANINEI,M1HLT0.82
DPND-PHENYLALANINEA,H,L1J9C0.82
DPND-PHENYLALANINEI,T1TMB0.82
DPND-PHENYLALANINEA2JRY0.82
DPND-PHENYLALANINEA2SOC0.82
DPND-PHENYLALANINEA2YYF0.82
DPND-PHENYLALANINEI2HGT0.82
DPND-PHENYLALANINEA,D2Q3I0.82
DPND-PHENYLALANINEA,P1MCD0.82
DPND-PHENYLALANINEP1HAO0.82
DPND-PHENYLALANINEA,B,I1Z8J0.82
DPND-PHENYLALANINEA,B,C2PGQ0.82
DPND-PHENYLALANINEC,D,H,I,L,M,
X,Y
1DVA0.82
DPND-PHENYLALANINEP1NRR0.82
DPND-PHENYLALANINEI1PPB0.82
DPND-PHENYLALANINEC,D,G,H1NU70.82
DPND-PHENYLALANINEI2HPP0.82
DPND-PHENYLALANINEB,C2OD30.82
DPND-PHENYLALANINEA1B0Q0.82
DPND-PHENYLALANINEB,C,E,F1NU90.82
DPND-PHENYLALANINEA,B,I1Z8I0.82
DPND-PHENYLALANINEH,I,J1TMU0.82
DPND-PHENYLALANINEA,B,C,D,E,F2DNS0.82
DPND-PHENYLALANINEA1GO90.82
DPND-PHENYLALANINEB,C,E,F1A0H0.82
DPND-PHENYLALANINEP1MCF0.82
DPND-PHENYLALANINEA2RME0.82
DPND-PHENYLALANINEH,I1TMT0.82
DPND-PHENYLALANINEI1ABI0.82
DPND-PHENYLALANINER1NRQ0.82
DPND-PHENYLALANINEB,C,F,G2A1D0.82
DPND-PHENYLALANINEA,B2Q330.82
DPND-PHENYLALANINEC,H,L1DAN0.82
DPND-PHENYLALANINEP1MCE0.82
DPND-PHENYLALANINEB,C,E,F2A450.82
DPND-PHENYLALANINEA2RMI0.82
DPND-PHENYLALANINEA,B,I1TQ70.82
DPND-PHENYLALANINEA1W7M0.82
DPND-PHENYLALANINEP1HAP0.82
DPND-PHENYLALANINEA,B1ORF0.82
DPND-PHENYLALANINEI1IHS0.82
DPND-PHENYLALANINEP1MCC0.82
DPND-PHENYLALANINEA2RMD0.82
DPND-PHENYLALANINEA2JQB0.82
DPND-PHENYLALANINEI2HPQ0.82
DPND-PHENYLALANINEC,E,F1SHH0.82
DPND-PHENYLALANINEA,I1CVR0.82
DPND-PHENYLALANINEL,P1AUT0.82
DPND-PHENYLALANINEP1MCI0.82
DPND-PHENYLALANINEH,I3F6U0.82
DPND-PHENYLALANINEA1BFW0.82
DPND-PHENYLALANINEH,I1HAI0.82
DPND-PHENYLALANINEB,C2THF0.82
DPND-PHENYLALANINEI1IHT0.82
DPND-PHENYLALANINEA,P1MCJ0.82
DPND-PHENYLALANINEA1TKH0.82
DPND-PHENYLALANINEC,H,L,T2FIR0.82
DPND-PHENYLALANINEA2FMZ0.82
DPND-PHENYLALANINEA1YL90.82
DPND-PHENYLALANINEI1HUT0.82
DPND-PHENYLALANINEI1FXY0.82
DPND-PHENYLALANINEA1YL80.82
DPND-PHENYLALANINEC,H,L1QFK0.82
DPND-PHENYLALANINEP1MCB0.82
ZYZ(4-{(2S)-2-[(tert-butoxycarbonyl)amino]-
3-methoxy-3-oxopropyl}phenyl)methaneseleninic acid
A3D9C0.75
TFQ4-(2,2,2-TRIFLUOROETHYL)-L-PHENYLALANINEA3D6V0.78
ZAEN-methyl-D-phenylalanineH,I,R1TBZ0.79
0A9methyl L-phenylalaninateA1AY20.88
0A9methyl L-phenylalaninateI5ER10.88
0A9methyl L-phenylalaninateI,P1HDT0.88
2004-CHLORO-L-PHENYLALANINEA,B2AKW0.9
LLG2-aminoethyl naphthalen-1-ylacetateA3BC40.73
IGLALPHA-AMINO-2-INDANACETIC ACIDA1BDK0.75
PM32-AMINO-3-(4-PHOSPHONOMETHYL-PHENYL)-
PROPIONIC ACID
A,L,M3FEA0.75
PM32-AMINO-3-(4-PHOSPHONOMETHYL-PHENYL)-
PROPIONIC ACID
P1CWD0.75
PM32-AMINO-3-(4-PHOSPHONOMETHYL-PHENYL)-
PROPIONIC ACID
L3FE70.75
PM32-AMINO-3-(4-PHOSPHONOMETHYL-PHENYL)-
PROPIONIC ACID
B2GV20.75
PM32-AMINO-3-(4-PHOSPHONOMETHYL-PHENYL)-
PROPIONIC ACID
B,D1CWE0.75
IOYP-IODO-D-PHENYLALANINEA1XBU0.8
NDFN-(CARBOXYCARBONYL)-D-PHENYLALANINEA1YCI0.73
M18{(2S)-1-[N-(tert-butoxycarbonyl)glycyl]pyrrolidin-
2-yl}methyl (3-chlorophenyl)acetate
H,I3EGK0.76