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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03843912

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
ZAEN-methyl-D-phenylalanineH,I,R1TBZ0.74
MINMETHYL-PHE-PRO-AMINO-CYCLOHEXYLGLYCINEH,I1TOM0.74
2004-CHLORO-L-PHENYLALANINEA,B2AKW0.72
LPF1,1,1-TRIFLUORO-3-((N-ACETYL)-L-
LEUCYLAMIDO)-4-PHENYL-BUTAN-2-ONE(N-
ACETYL-L-LEUCYL-L-PHENYLALANYL TRIFLUOROMETHYL KETONE)
G7GCH0.76
PCSPHENYLALANYLMETHYLCHLORIDEB,D1DLK0.78
PCSPHENYLALANYLMETHYLCHLORIDEA1XQX0.78
872(3R)-4-[(3R)-3-AMINO-4-(2,4,5-TRIFLUOROPHENYL)BUTANOYL]-
3-(2,2,2-TRIFLUOROETHYL)-1,4-DIAZEPAN-
2-ONE
A,B2IIT0.72
FRFPHE-REDUCED-PHEA,I1GVX0.72
NFP3-AMINO-5-PHENYLPENTANEA1MEM0.72
NFP3-AMINO-5-PHENYLPENTANEA,D,E1FH00.72
PSSETHYLAMINOBENZYLMETHYLCARBONYL GROUPA1EAG0.77
SP8N-{(1S)-3-[(4-aminobutyl)amino]-
1-methylpropyl}benzamide
A,B3CNS0.72
IPOPARA-IODO-D-PHENYLALANINE HYDROXAMIC ACIDA1IGB1
NAMNAM NAPTHYLAMINOALANINEA,B,I,J3FIV0.81
NAMNAM NAPTHYLAMINOALANINEA,B,I,J2FIV0.81
FCL3-CHLORO-L-PHENYLALANINEE,F1OKW0.72
D7PD-PHENYLALANYL-N~5~-[(2,2-DIHYDROXYHYDRAZINO)(IMINO)METHYL]-
D-ORNITHINAMIDE
A,B1RS70.72
D7PD-PHENYLALANYL-N~5~-[(2,2-DIHYDROXYHYDRAZINO)(IMINO)METHYL]-
D-ORNITHINAMIDE
A,B1RS90.72
APMM-AMIDINOPHENYL-3-ALANINEE1PPH0.7
EOAN-PHENETHYL-FORMAMIDEH,I1A5G0.7
PPB1-{[1-(2-AMINO-3-PHENYL-PROPIONYL)-
PYRROLIDINE-2-CARBONYL]-AMINO}-
2-(3-CYANO-PHENYL)-ETHANEBORONIC ACID
A1AUJ0.71
FAF2-ACETYLAMINO-4-METHYL-PENTANOIC ACID (1-
FORMYL-2-PHENYL-ETHYL)-AMIDE
B,C1GGD0.77
PHIIODO-PHENYLALANINEA1TF90.82
PHIIODO-PHENYLALANINEA,B,C,D1ORW0.82
PHIIODO-PHENYLALANINEA1T6H0.82
PHIIODO-PHENYLALANINEA,B,C1NLU0.82
PHIIODO-PHENYLALANINEA,I1GA10.82
PHIIODO-PHENYLALANINEA,I1GA40.82
PHIIODO-PHENYLALANINEP1CZI0.82
DI5AC-(D)PHE-PRO-BOROHOMOORNITHINE-
OH
H1LHG0.77
4PH4-methyl-L-phenylalanineB,C3BV90.77
PEA2-PHENYLETHYLAMINEA,B,E,F,G,H1MHW0.73
PEA2-PHENYLETHYLAMINEA1TNJ0.73
PEA2-PHENYLETHYLAMINED,H2HKM0.73
PEA2-PHENYLETHYLAMINEA1UTO0.73
PEA2-PHENYLETHYLAMINEA,B1D6Y0.73
PEA2-PHENYLETHYLAMINEA,B1D6Z0.73
PEA2-PHENYLETHYLAMINEA,B1D6U0.73
PEA2-PHENYLETHYLAMINEA1UTM0.73
1PAPHENYLMETHYLACETIC ACID ALANINEI1BHF0.75
PHAPHENYLALANINALA,B1OB20.83
PHAPHENYLALANINALV,Y,Z2WDG0.83
PHAPHENYLALANINALV,Y,Z2WDK0.83
PHAPHENYLALANINAL1,2,4,5,A,B,
C,D,E,J,K,L,
M,N,O,P,R,S,
T,U,V,Z
1M900.83
PHAPHENYLALANINALP3SGA0.83
PHAPHENYLALANINALA,B,C,D,E,F1OB50.83
PHAPHENYLALANINALV,Y,Z2WDM0.83
PHAPHENYLALANINAL0,2,4,9,A,B,
C,H,I,J,K,L,
M,N,P,Q,R,S,
T,X,Y,Z
1KQS0.83
PHAPHENYLALANINALA,B1KDV0.83
PHAPHENYLALANINAL1,2,4,5,6,A,
B,C,D,E,J,K,
L,M,N,O,P,R,
S,T,U,V,Z
1Q860.83
PHAPHENYLALANINALA,B1KDY0.83
PHAPHENYLALANINALV,Y,Z3FIC0.83
PHAPHENYLALANINALV,Y,Z2WDH0.83
PHAPHENYLALANINALA,B1KE20.83
HPEHOMOPHENYLALANINEA,B1B1H0.77
TI1[2(R,S)-2-SULFANYLHEPTANOYL]-PHE-
ALA
A1R1I0.72
TI1[2(R,S)-2-SULFANYLHEPTANOYL]-PHE-
ALA
A1QF10.72
HMF2-AMINO-4-PHENYL-BUTYRIC ACIDI,J1AY60.77
FRD1-PHENYL-2-AMINOPROPANEA,C2AOI0.74
FRD1-PHENYL-2-AMINOPROPANEA,B,C2AOF0.74
FRD1-PHENYL-2-AMINOPROPANEA,B,C2AOJ0.74
FRD1-PHENYL-2-AMINOPROPANEA,B,C2AOH0.74
NALBETA-(2-NAPHTHYL)-ALANINEA,B2ITK0.71
NALBETA-(2-NAPHTHYL)-ALANINEH,I4THN0.71
NALBETA-(2-NAPHTHYL)-ALANINEA,B2Q5A0.71
NALBETA-(2-NAPHTHYL)-ALANINEA1ZWU0.71
NALBETA-(2-NAPHTHYL)-ALANINEA1SKL0.71
NALBETA-(2-NAPHTHYL)-ALANINEH,I5GDS0.71
NALBETA-(2-NAPHTHYL)-ALANINEA1ZH00.71
NALBETA-(2-NAPHTHYL)-ALANINEA,B2JT90.71
INGD-[(AMINO)CARBONYL]PHENYLALANINEA,B1UF80.73
INGD-[(AMINO)CARBONYL]PHENYLALANINEA,B,D,E1HDU0.73
5FH(5S)-5-benzylimidazolidine-2,4-
dione
A2JLO0.77
51UD-phenylalanyl-N-(3-methylbenzyl)-
L-prolinamide
H,I2ZF00.71
DBZ3-(BENZOYLAMINO)-L-ALANINEA,B,C,D1SN90.71
DBZ3-(BENZOYLAMINO)-L-ALANINEA,B1SNE0.71
DBZ3-(BENZOYLAMINO)-L-ALANINEA,B,C,D1SNA0.71
DBZ3-(BENZOYLAMINO)-L-ALANINEA,B1XOF0.71
INFD-[(N-HYDROXYAMINO)CARBONYL]PHENYLALANINEA1HDQ0.74
37UD-phenylalanyl-N-(3-fluorobenzyl)-
L-prolinamide
H,I2ZDV0.71
BVATRIHYDROXY[(N-HYDROXYBENZAMIDATO)OXO]VANADATEB,C2P8O0.74
53UD-phenylalanyl-N-benzyl-L-prolinamideH,I2ZFF0.73
FPA1,1 DIFLUORO-N-PHENYLETHYL ACETAMIDEE,I4EST0.71
CXAPHENYLALANINE-N-SULFONAMIDEA1IY70.77
S27N-[[2-METHYL-4-HYDROXYCARBAMOYL]BUT-
4-YL-N]-BENZYL-P-[PHENYL]-P-[METHYL]PHOSPHINAMID
A,B1B3D0.74
PPH[(1R)-1-amino-2-phenylethyl]phosphonic acidA1OS00.71
PPH[(1R)-1-amino-2-phenylethyl]phosphonic acidE,I4TMN0.71
PPH[(1R)-1-amino-2-phenylethyl]phosphonic acidS1CGH0.71
PG9D-PHENYLGLYCINEA,B,G,H10GS0.74
PG9D-PHENYLGLYCINEA,B,C,D2B4K0.74
TPATRANS-2-PHENYLCYCLOPROPYLAMINEA1TNL0.71
BIF(R)-2-AMINO-3-(4-PHENYLCYCLOHEXYL)PROPANOIC ACIDG,M,P,S1YYL0.75
BIF(R)-2-AMINO-3-(4-PHENYLCYCLOHEXYL)PROPANOIC ACIDG,M,P,S2I5Y0.75
JNH1-[2-(S)-AMINO-3-BIPHENYL-4-YL-
PROPIONYL]-PYRROLIDINE-2-(S)-CARBONITRILE
I,J2AJL0.75
NFAPHENYLALANINE AMIDEA,B,C,D2BTJ0.91
NFAPHENYLALANINE AMIDEA,B,C,D,E,F2EFX0.91
NFAPHENYLALANINE AMIDEA,B,C,D2VVJ0.91
NFAPHENYLALANINE AMIDEA2A4O0.91
NFAPHENYLALANINE AMIDEA,B1XAE0.91
NFAPHENYLALANINE AMIDEA,B,C,D2OGR0.91
NFAPHENYLALANINE AMIDEA,B,C,D1QA70.91
NFAPHENYLALANINE AMIDEA,B,C,D2GW40.91
NDFN-(CARBOXYCARBONYL)-D-PHENYLALANINEA1YCI0.72
PHLL-PHENYLALANINOLA,B1JOH0.7
PHLL-PHENYLALANINOLI3APR0.7
PHLL-PHENYLALANINOLA1DLZ0.7
PHLL-PHENYLALANINOLA1IH90.7
PHLL-PHENYLALANINOLA1OB40.7
PHLL-PHENYLALANINOLI2ER60.7
PHLL-PHENYLALANINOLA1R9U0.7
PHLL-PHENYLALANINOLA1OB70.7
PHLL-PHENYLALANINOLA,B1OB60.7
PHLL-PHENYLALANINOLA,B,C1AMT0.7
44Ubeta-phenyl-D-phenylalanyl-N-propyl-
L-prolinamide
B,D3DA90.73
APHP-AMIDINOPHENYL-3-ALANINEE,I1PPC0.7
APHP-AMIDINOPHENYL-3-ALANINEH1ETS0.7
APHP-AMIDINOPHENYL-3-ALANINEH1ETT0.7
APHP-AMIDINOPHENYL-3-ALANINEI1QUR0.7
IPP(P-IODOPHENYLACETYLAMINO)METHYLPHOSPHINIC ACIDA,B1BLS0.79
002N-[(2R)-2-BENZYL-4-(HYDROXYAMINO)-
4-OXOBUTANOYL]-L-ISOLEUCYL-L-LEUCINE
A,B2FV90.73
DPND-PHENYLALANINEP1MCS0.79
DPND-PHENYLALANINEA1GOE0.79
DPND-PHENYLALANINEA2RM90.79
DPND-PHENYLALANINEA1SOC0.79
DPND-PHENYLALANINEB,C,E,F1SFQ0.79
DPND-PHENYLALANINEI1ABJ0.79
DPND-PHENYLALANINEP1DWE0.79
DPND-PHENYLALANINEI,M1HLT0.79
DPND-PHENYLALANINEA,H,L1J9C0.79
DPND-PHENYLALANINEI,T1TMB0.79
DPND-PHENYLALANINEA2JRY0.79
DPND-PHENYLALANINEA2SOC0.79
DPND-PHENYLALANINEA2YYF0.79
DPND-PHENYLALANINEI2HGT0.79
DPND-PHENYLALANINEA,D2Q3I0.79
DPND-PHENYLALANINEA,P1MCD0.79
DPND-PHENYLALANINEP1HAO0.79
DPND-PHENYLALANINEA,B,I1Z8J0.79
DPND-PHENYLALANINEA,B,C2PGQ0.79
DPND-PHENYLALANINEC,D,H,I,L,M,
X,Y
1DVA0.79
DPND-PHENYLALANINEP1NRR0.79
DPND-PHENYLALANINEI1PPB0.79
DPND-PHENYLALANINEC,D,G,H1NU70.79
DPND-PHENYLALANINEI2HPP0.79
DPND-PHENYLALANINEB,C2OD30.79
DPND-PHENYLALANINEA1B0Q0.79
DPND-PHENYLALANINEB,C,E,F1NU90.79
DPND-PHENYLALANINEA,B,I1Z8I0.79
DPND-PHENYLALANINEH,I,J1TMU0.79
DPND-PHENYLALANINEA,B,C,D,E,F2DNS0.79
DPND-PHENYLALANINEA1GO90.79
DPND-PHENYLALANINEB,C,E,F1A0H0.79
DPND-PHENYLALANINEP1MCF0.79
DPND-PHENYLALANINEA2RME0.79
DPND-PHENYLALANINEH,I1TMT0.79
DPND-PHENYLALANINEI1ABI0.79
DPND-PHENYLALANINER1NRQ0.79
DPND-PHENYLALANINEB,C,F,G2A1D0.79
DPND-PHENYLALANINEA,B2Q330.79
DPND-PHENYLALANINEC,H,L1DAN0.79
DPND-PHENYLALANINEP1MCE0.79
DPND-PHENYLALANINEB,C,E,F2A450.79
DPND-PHENYLALANINEA2RMI0.79
DPND-PHENYLALANINEA,B,I1TQ70.79
DPND-PHENYLALANINEA1W7M0.79
DPND-PHENYLALANINEP1HAP0.79
DPND-PHENYLALANINEA,B1ORF0.79
DPND-PHENYLALANINEI1IHS0.79
DPND-PHENYLALANINEP1MCC0.79
DPND-PHENYLALANINEA2RMD0.79
DPND-PHENYLALANINEA2JQB0.79
DPND-PHENYLALANINEI2HPQ0.79
DPND-PHENYLALANINEC,E,F1SHH0.79
DPND-PHENYLALANINEA,I1CVR0.79
DPND-PHENYLALANINEL,P1AUT0.79
DPND-PHENYLALANINEP1MCI0.79
DPND-PHENYLALANINEH,I3F6U0.79
DPND-PHENYLALANINEA1BFW0.79
DPND-PHENYLALANINEH,I1HAI0.79
DPND-PHENYLALANINEB,C2THF0.79
DPND-PHENYLALANINEI1IHT0.79
DPND-PHENYLALANINEA,P1MCJ0.79
DPND-PHENYLALANINEA1TKH0.79
DPND-PHENYLALANINEC,H,L,T2FIR0.79
DPND-PHENYLALANINEA2FMZ0.79
DPND-PHENYLALANINEA1YL90.79
DPND-PHENYLALANINEI1HUT0.79
DPND-PHENYLALANINEI1FXY0.79
DPND-PHENYLALANINEA1YL80.79
DPND-PHENYLALANINEC,H,L1QFK0.79
DPND-PHENYLALANINEP1MCB0.79
4AF4-ACETYL-L-PHENYLALANINEA1ZH60.71
IGLALPHA-AMINO-2-INDANACETIC ACIDA1BDK0.72
565(3R)-4-[(3R)-3-AMINO-4-(2,4,5-TRIFLUOROPHENYL)BUTANOYL]-
3-METHYL-1,4-DIAZEPAN-2-ONE
A,B2IIV0.73
TFQ4-(2,2,2-TRIFLUOROETHYL)-L-PHENYLALANINEA3D6V0.75
PM32-AMINO-3-(4-PHOSPHONOMETHYL-PHENYL)-
PROPIONIC ACID
A,L,M3FEA0.72
PM32-AMINO-3-(4-PHOSPHONOMETHYL-PHENYL)-
PROPIONIC ACID
P1CWD0.72
PM32-AMINO-3-(4-PHOSPHONOMETHYL-PHENYL)-
PROPIONIC ACID
L3FE70.72
PM32-AMINO-3-(4-PHOSPHONOMETHYL-PHENYL)-
PROPIONIC ACID
B2GV20.72
PM32-AMINO-3-(4-PHOSPHONOMETHYL-PHENYL)-
PROPIONIC ACID
B,D1CWE0.72
PDH(2S)-2-AMINO-3-PHENYL-1-PROPANOLA1GQ00.7
HPQHOMOPHENYLALANINYLMETHANEB1EWP0.82
TYCL-TYROSINAMIDEA2BF90.73
TYCL-TYROSINAMIDEA2OCI0.73
PFF4-FLUORO-L-PHENYLALANINEA3F3C0.77
PFF4-FLUORO-L-PHENYLALANINEA,C,E,F2UUE0.77
PFF4-FLUORO-L-PHENYLALANINEA1ZNT0.77
PFF4-FLUORO-L-PHENYLALANINEF,H1OL10.77
PFF4-FLUORO-L-PHENYLALANINEA,C,F,H2C5V0.77
PFF4-FLUORO-L-PHENYLALANINEE,F1OL20.77
B2FPHENYLALANINE BORONIC ACIDA,P1GBM0.76
B2FPHENYLALANINE BORONIC ACIDA,P1GBD0.76
B2FPHENYLALANINE BORONIC ACIDA,P1P060.76
B2FPHENYLALANINE BORONIC ACIDA,P1GBI0.76
B2FPHENYLALANINE BORONIC ACIDA,P8LPR0.76
IAM4-[(ISOPROPYLAMINO)METHYL]PHENYLALANINEA1XY50.71
IAM4-[(ISOPROPYLAMINO)METHYL]PHENYLALANINEA1XY80.71
IAM4-[(ISOPROPYLAMINO)METHYL]PHENYLALANINEA1XY90.71
IAM4-[(ISOPROPYLAMINO)METHYL]PHENYLALANINEA1XXZ0.71
IAM4-[(ISOPROPYLAMINO)METHYL]PHENYLALANINEA1XY40.71
IAM4-[(ISOPROPYLAMINO)METHYL]PHENYLALANINEA1XY60.71
APD3-METHYLPHENYLALANINEA,B,C1GMY0.77
PRA3-PHENYLPROPYLAMINEA1TNK0.72
PRA3-PHENYLPROPYLAMINEM1UTL0.72
PHMPHENYLALANYLMETHANEA,I1PJP0.84
PHMPHENYLALANYLMETHANEA,B,C2J9J0.84
PHMPHENYLALANYLMETHANEA,B,C2JE40.84
APF1,1,1-TRIFLUORO-3-ACETAMIDO-4-PHENYL BUTAN-
2-ONE(N-ACETYL-L-PHENYLALANYL TRIFLUOROMETHYL KETONE)
B,C1GG60.77
APF1,1,1-TRIFLUORO-3-ACETAMIDO-4-PHENYL BUTAN-
2-ONE(N-ACETYL-L-PHENYLALANYL TRIFLUOROMETHYL KETONE)
G6GCH0.77
KELN-[(2R)-2-benzyl-4-(hydroxyamino)-
4-oxobutanoyl]-L-alanine
X3B7U0.75
PBN4-PHENYLBUTYLAMINEA1TNI0.72
PBN4-PHENYLBUTYLAMINEA1UTP0.72
LHYL-[(N-HYDROXYAMINO)CARBONYL]PHENYLALANINEA,B,D,E1HEE0.74
T16BOROLOG2H1A3E0.7
PO01-BENZYL-(R)-PROPYLAMINEA,I1LZQ0.74
PO01-BENZYL-(R)-PROPYLAMINEB,I1M0B0.74
PSA3-HYDROXY-4-AMINO-5-PHENYLPENTANOIC ACIDI1EPL0.7
PSA3-HYDROXY-4-AMINO-5-PHENYLPENTANOIC ACIDA,B,C,D2IFW0.7
PSA3-HYDROXY-4-AMINO-5-PHENYLPENTANOIC ACIDE,I1EPM0.7
FA4SM-25453A,B2D1O0.74
FA4SM-25453A,B2D1N0.74
IOYP-IODO-D-PHENYLALANINEA1XBU0.82
0A9methyl L-phenylalaninateA1AY20.76
0A9methyl L-phenylalaninateI5ER10.76
0A9methyl L-phenylalaninateI,P1HDT0.76
HIN(2S) N-ACETYL-L-ALANYL-ALPHAL-PHENYLALANYL-
CHLOROETHYLKETONE
B2GMT0.74
ALNNAPHTHALEN-2-YL-3-ALANINEA,B,I,J2FIV0.71
ALNNAPHTHALEN-2-YL-3-ALANINEA,B1B0H0.71
ALNNAPHTHALEN-2-YL-3-ALANINEB1FIV0.71
ALNNAPHTHALEN-2-YL-3-ALANINEA,B,I,J3FIV0.71
BHOBENZHYDROXAMIC ACIDA,B1GX20.76
BHOBENZHYDROXAMIC ACIDA1HSR0.76
BHOBENZHYDROXAMIC ACIDA,B2ATJ0.76
BHOBENZHYDROXAMIC ACIDA,B4ATJ0.76
BHOBENZHYDROXAMIC ACIDA,B3ATJ0.76
BHOBENZHYDROXAMIC ACIDA3GCK0.76
BHOBENZHYDROXAMIC ACIDA,B,C,D,E,F,
G,H
2BOY0.76
PLHMETHYLAMINO-PHENYLALANYL-LEUCYL-
HYDROXAMIC ACID
A1HFC0.82
PLHMETHYLAMINO-PHENYLALANYL-LEUCYL-
HYDROXAMIC ACID
A1MNC0.82
DI4AC-(D)PHE-PRO-BOROHOMOLYS-OHH1LHF0.76
SP9N-{(1R)-3-[(4-aminobutyl)amino]-
1-methylpropyl}benzamide
A,B3CNT0.72
PFCPHENYLFERRICROCIN-IRONA1QJQ0.73
4BF4-BROMO-L-PHENYLALANINEA2AG60.72
MEAN-METHYLPHENYLALANINEA2PIL0.74
MEAN-METHYLPHENYLALANINEA,B,C,D1H0I0.74
MEAN-METHYLPHENYLALANINEA,B,I1DOJ0.74
DP7AC-(D)PHE-PRO-BOROARG-OHH1LHC0.71
DFMN-ACETYL-L-PHENYLALANYL-4-[DIFLUORO(PHOSPHONO)METHYL]-
L-PHENYLALANINAMIDE
A2CMC0.71
DI2AC-(D)PHE-PRO-BOROLYS-OHH1LHD0.76
DI3AC-(D)PHE-PRO-BORO-N-BUTYL-AMIDINO-
GLYCINE-OH
H1LHE0.71
IYR3-IODO-TYROSINEA2D980.7
IYR3-IODO-TYROSINEA2D8P0.7
IYR3-IODO-TYROSINEA,B3GFD0.7
IYR3-IODO-TYROSINEA2R1Q0.7
IYR3-IODO-TYROSINEA2ZP10.7
IYR3-IODO-TYROSINEA,B,C,D2ZXV0.7
IYR3-IODO-TYROSINEC1CF00.7
IYR3-IODO-TYROSINEA1XXZ0.7
IYR3-IODO-TYROSINEA2D970.7
IYR3-IODO-TYROSINEA1XY90.7
IYR3-IODO-TYROSINEA2Z100.7
IYR3-IODO-TYROSINEA1WQ30.7
IYR3-IODO-TYROSINEA2D8O0.7
IYR3-IODO-TYROSINEA2D8W0.7
IYR3-IODO-TYROSINEA2Z110.7