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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00483172

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
IPOPARA-IODO-D-PHENYLALANINE HYDROXAMIC ACIDA1IGB0.78
C2A1-(3-CHLOROPHENYL)METHANAMINEB,I2C8Z0.71
DPND-PHENYLALANINEP1MCS0.77
DPND-PHENYLALANINEA1GOE0.77
DPND-PHENYLALANINEA2RM90.77
DPND-PHENYLALANINEA1SOC0.77
DPND-PHENYLALANINEB,C,E,F1SFQ0.77
DPND-PHENYLALANINEI1ABJ0.77
DPND-PHENYLALANINEP1DWE0.77
DPND-PHENYLALANINEI,M1HLT0.77
DPND-PHENYLALANINEA,H,L1J9C0.77
DPND-PHENYLALANINEI,T1TMB0.77
DPND-PHENYLALANINEA2JRY0.77
DPND-PHENYLALANINEA2SOC0.77
DPND-PHENYLALANINEA2YYF0.77
DPND-PHENYLALANINEI2HGT0.77
DPND-PHENYLALANINEA,D2Q3I0.77
DPND-PHENYLALANINEA,P1MCD0.77
DPND-PHENYLALANINEP1HAO0.77
DPND-PHENYLALANINEA,B,I1Z8J0.77
DPND-PHENYLALANINEA,B,C2PGQ0.77
DPND-PHENYLALANINEC,D,H,I,L,M,
X,Y
1DVA0.77
DPND-PHENYLALANINEP1NRR0.77
DPND-PHENYLALANINEI1PPB0.77
DPND-PHENYLALANINEC,D,G,H1NU70.77
DPND-PHENYLALANINEI2HPP0.77
DPND-PHENYLALANINEB,C2OD30.77
DPND-PHENYLALANINEA1B0Q0.77
DPND-PHENYLALANINEB,C,E,F1NU90.77
DPND-PHENYLALANINEA,B,I1Z8I0.77
DPND-PHENYLALANINEH,I,J1TMU0.77
DPND-PHENYLALANINEA,B,C,D,E,F2DNS0.77
DPND-PHENYLALANINEA1GO90.77
DPND-PHENYLALANINEB,C,E,F1A0H0.77
DPND-PHENYLALANINEP1MCF0.77
DPND-PHENYLALANINEA2RME0.77
DPND-PHENYLALANINEH,I1TMT0.77
DPND-PHENYLALANINEI1ABI0.77
DPND-PHENYLALANINER1NRQ0.77
DPND-PHENYLALANINEB,C,F,G2A1D0.77
DPND-PHENYLALANINEA,B2Q330.77
DPND-PHENYLALANINEC,H,L1DAN0.77
DPND-PHENYLALANINEP1MCE0.77
DPND-PHENYLALANINEB,C,E,F2A450.77
DPND-PHENYLALANINEA2RMI0.77
DPND-PHENYLALANINEA,B,I1TQ70.77
DPND-PHENYLALANINEA1W7M0.77
DPND-PHENYLALANINEP1HAP0.77
DPND-PHENYLALANINEA,B1ORF0.77
DPND-PHENYLALANINEI1IHS0.77
DPND-PHENYLALANINEP1MCC0.77
DPND-PHENYLALANINEA2RMD0.77
DPND-PHENYLALANINEA2JQB0.77
DPND-PHENYLALANINEI2HPQ0.77
DPND-PHENYLALANINEC,E,F1SHH0.77
DPND-PHENYLALANINEA,I1CVR0.77
DPND-PHENYLALANINEL,P1AUT0.77
DPND-PHENYLALANINEP1MCI0.77
DPND-PHENYLALANINEH,I3F6U0.77
DPND-PHENYLALANINEA1BFW0.77
DPND-PHENYLALANINEH,I1HAI0.77
DPND-PHENYLALANINEB,C2THF0.77
DPND-PHENYLALANINEI1IHT0.77
DPND-PHENYLALANINEA,P1MCJ0.77
DPND-PHENYLALANINEA1TKH0.77
DPND-PHENYLALANINEC,H,L,T2FIR0.77
DPND-PHENYLALANINEA2FMZ0.77
DPND-PHENYLALANINEA1YL90.77
DPND-PHENYLALANINEI1HUT0.77
DPND-PHENYLALANINEI1FXY0.77
DPND-PHENYLALANINEA1YL80.77
DPND-PHENYLALANINEC,H,L1QFK0.77
DPND-PHENYLALANINEP1MCB0.77
PHMPHENYLALANYLMETHANEA,I1PJP0.9
PHMPHENYLALANYLMETHANEA,B,C2J9J0.9
PHMPHENYLALANYLMETHANEA,B,C2JE40.9
FCL3-CHLORO-L-PHENYLALANINEE,F1OKW0.78
CXAPHENYLALANINE-N-SULFONAMIDEA1IY70.73
1PAPHENYLMETHYLACETIC ACID ALANINEI1BHF0.73
4AF4-ACETYL-L-PHENYLALANINEA1ZH60.72
PEA2-PHENYLETHYLAMINEA,B,E,F,G,H1MHW0.75
PEA2-PHENYLETHYLAMINEA1TNJ0.75
PEA2-PHENYLETHYLAMINED,H2HKM0.75
PEA2-PHENYLETHYLAMINEA1UTO0.75
PEA2-PHENYLETHYLAMINEA,B1D6Y0.75
PEA2-PHENYLETHYLAMINEA,B1D6Z0.75
PEA2-PHENYLETHYLAMINEA,B1D6U0.75
PEA2-PHENYLETHYLAMINEA1UTM0.75
HPEHOMOPHENYLALANINEA,B1B1H0.75
V35D-1-(4-CHLOROPHENYL)-2-(ACETAMIDO)ETHANE BORONIC ACIDB,C2VGC0.7
2004-CHLORO-L-PHENYLALANINEA,B2AKW0.78
PCSPHENYLALANYLMETHYLCHLORIDEB,D1DLK1
PCSPHENYLALANYLMETHYLCHLORIDEA1XQX1
HMF2-AMINO-4-PHENYL-BUTYRIC ACIDI,J1AY60.75
PG9D-PHENYLGLYCINEA,B,G,H10GS0.72
PG9D-PHENYLGLYCINEA,B,C,D2B4K0.72
PO01-BENZYL-(R)-PROPYLAMINEA,I1LZQ0.76
PO01-BENZYL-(R)-PROPYLAMINEB,I1M0B0.76
ZAEN-methyl-D-phenylalanineH,I,R1TBZ0.72
4PH4-methyl-L-phenylalanineB,C3BV90.75
HIN(2S) N-ACETYL-L-ALANYL-ALPHAL-PHENYLALANYL-
CHLOROETHYLKETONE
B2GMT0.82
PBFPARA-(BENZOYL)-PHENYLALANINEA2FR90.71
PBFPARA-(BENZOYL)-PHENYLALANINEA,B1EEN0.71
PBFPARA-(BENZOYL)-PHENYLALANINEA2HGZ0.71
PBFPARA-(BENZOYL)-PHENYLALANINEA2FRB0.71
B2FPHENYLALANINE BORONIC ACIDA,P1GBM0.74
B2FPHENYLALANINE BORONIC ACIDA,P1GBD0.74
B2FPHENYLALANINE BORONIC ACIDA,P1P060.74
B2FPHENYLALANINE BORONIC ACIDA,P1GBI0.74
B2FPHENYLALANINE BORONIC ACIDA,P8LPR0.74
TCKN-[(1S)-5-amino-1-(chloroacetyl)pentyl]-
4-methylbenzenesulfonamide
A1ARC0.81
C2B1-(4-CHLOROPHENYL)METHANAMINED,H2Q7Q0.71
BIF(R)-2-AMINO-3-(4-PHENYLCYCLOHEXYL)PROPANOIC ACIDG,M,P,S1YYL0.73
BIF(R)-2-AMINO-3-(4-PHENYLCYCLOHEXYL)PROPANOIC ACIDG,M,P,S2I5Y0.73
IOYP-IODO-D-PHENYLALANINEA1XBU0.75
NFP3-AMINO-5-PHENYLPENTANEA1MEM0.73
NFP3-AMINO-5-PHENYLPENTANEA,D,E1FH00.73
PHAPHENYLALANINALA,B1OB20.85
PHAPHENYLALANINALV,Y,Z2WDG0.85
PHAPHENYLALANINALV,Y,Z2WDK0.85
PHAPHENYLALANINAL1,2,4,5,A,B,
C,D,E,J,K,L,
M,N,O,P,R,S,
T,U,V,Z
1M900.85
PHAPHENYLALANINALP3SGA0.85
PHAPHENYLALANINALA,B,C,D,E,F1OB50.85
PHAPHENYLALANINALV,Y,Z2WDM0.85
PHAPHENYLALANINAL0,2,4,9,A,B,
C,H,I,J,K,L,
M,N,P,Q,R,S,
T,X,Y,Z
1KQS0.85
PHAPHENYLALANINALA,B1KDV0.85
PHAPHENYLALANINAL1,2,4,5,6,A,
B,C,D,E,J,K,
L,M,N,O,P,R,
S,T,U,V,Z
1Q860.85
PHAPHENYLALANINALA,B1KDY0.85
PHAPHENYLALANINALV,Y,Z3FIC0.85
PHAPHENYLALANINALV,Y,Z2WDH0.85
PHAPHENYLALANINALA,B1KE20.85
PHIIODO-PHENYLALANINEA1TF90.75
PHIIODO-PHENYLALANINEA,B,C,D1ORW0.75
PHIIODO-PHENYLALANINEA1T6H0.75
PHIIODO-PHENYLALANINEA,B,C1NLU0.75
PHIIODO-PHENYLALANINEA,I1GA10.75
PHIIODO-PHENYLALANINEA,I1GA40.75
PHIIODO-PHENYLALANINEP1CZI0.75
TFQ4-(2,2,2-TRIFLUOROETHYL)-L-PHENYLALANINEA3D6V0.73
V36L-1-(4-CHLOROPHENYL)-2-(ACETAMIDO)ETHANE BORONIC ACIDB,C1VGC0.7
PSSETHYLAMINOBENZYLMETHYLCARBONYL GROUPA1EAG0.79
FAF2-ACETYLAMINO-4-METHYL-PENTANOIC ACID (1-
FORMYL-2-PHENYL-ETHYL)-AMIDE
B,C1GGD0.71
PM32-AMINO-3-(4-PHOSPHONOMETHYL-PHENYL)-
PROPIONIC ACID
A,L,M3FEA0.7
PM32-AMINO-3-(4-PHOSPHONOMETHYL-PHENYL)-
PROPIONIC ACID
P1CWD0.7
PM32-AMINO-3-(4-PHOSPHONOMETHYL-PHENYL)-
PROPIONIC ACID
L3FE70.7
PM32-AMINO-3-(4-PHOSPHONOMETHYL-PHENYL)-
PROPIONIC ACID
B2GV20.7
PM32-AMINO-3-(4-PHOSPHONOMETHYL-PHENYL)-
PROPIONIC ACID
B,D1CWE0.7
0Z6D-phenylalanyl-N-[(1S)-4-{[amino(iminio)methyl]amino}-
1-(chloroacetyl)butyl]-L-phenylalaninamide
H,L3ELA0.74
MEAN-METHYLPHENYLALANINEA2PIL0.72
MEAN-METHYLPHENYLALANINEA,B,C,D1H0I0.72
MEAN-METHYLPHENYLALANINEA,B,I1DOJ0.72
TPATRANS-2-PHENYLCYCLOPROPYLAMINEA1TNL0.73
LPF1,1,1-TRIFLUORO-3-((N-ACETYL)-L-
LEUCYLAMIDO)-4-PHENYL-BUTAN-2-ONE(N-
ACETYL-L-LEUCYL-L-PHENYLALANYL TRIFLUOROMETHYL KETONE)
G7GCH0.72
FRD1-PHENYL-2-AMINOPROPANEA,C2AOI0.76
FRD1-PHENYL-2-AMINOPROPANEA,B,C2AOF0.76
FRD1-PHENYL-2-AMINOPROPANEA,B,C2AOJ0.76
FRD1-PHENYL-2-AMINOPROPANEA,B,C2AOH0.76
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
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
0A9methyl L-phenylalaninateA1AY20.76
0A9methyl L-phenylalaninateI5ER10.76
0A9methyl L-phenylalaninateI,P1HDT0.76
PHK(2R,3S)-3-AMINO-1-CHLORO-4-PHENYL-
BUTAN-2-OL
A1MU00.76
PHK(2R,3S)-3-AMINO-1-CHLORO-4-PHENYL-
BUTAN-2-OL
A1XRL0.76
HPQHOMOPHENYLALANINYLMETHANEB1EWP0.88
JNH1-[2-(S)-AMINO-3-BIPHENYL-4-YL-
PROPIONYL]-PYRROLIDINE-2-(S)-CARBONITRILE
I,J2AJL0.7
4BF4-BROMO-L-PHENYLALANINEA2AG60.7
PFF4-FLUORO-L-PHENYLALANINEA3F3C0.75
PFF4-FLUORO-L-PHENYLALANINEA,C,E,F2UUE0.75
PFF4-FLUORO-L-PHENYLALANINEA1ZNT0.75
PFF4-FLUORO-L-PHENYLALANINEF,H1OL10.75
PFF4-FLUORO-L-PHENYLALANINEA,C,F,H2C5V0.75
PFF4-FLUORO-L-PHENYLALANINEE,F1OL20.75
0G6D-phenylalanyl-N-[(1S)-4-{[amino(iminio)methyl]amino}-
1-(chloroacetyl)butyl]-L-prolinamide
B,H,L3DD20.74
0G6D-phenylalanyl-N-[(1S)-4-{[amino(iminio)methyl]amino}-
1-(chloroacetyl)butyl]-L-prolinamide
B,D,F,H1XMN0.74
APD3-METHYLPHENYLALANINEA,B,C1GMY0.75
5FH(5S)-5-benzylimidazolidine-2,4-
dione
A2JLO0.71
PRA3-PHENYLPROPYLAMINEA1TNK0.74
PRA3-PHENYLPROPYLAMINEM1UTL0.74
PBN4-PHENYLBUTYLAMINEA1TNI0.74
PBN4-PHENYLBUTYLAMINEA1UTP0.74
NAMNAM NAPTHYLAMINOALANINEA,B,I,J3FIV0.75
NAMNAM NAPTHYLAMINOALANINEA,B,I,J2FIV0.75
NFAPHENYLALANINE AMIDEA,B,C,D2BTJ0.85
NFAPHENYLALANINE AMIDEA,B,C,D,E,F2EFX0.85
NFAPHENYLALANINE AMIDEA,B,C,D2VVJ0.85
NFAPHENYLALANINE AMIDEA2A4O0.85
NFAPHENYLALANINE AMIDEA,B1XAE0.85
NFAPHENYLALANINE AMIDEA,B,C,D2OGR0.85
NFAPHENYLALANINE AMIDEA,B,C,D1QA70.85
NFAPHENYLALANINE AMIDEA,B,C,D2GW40.85
GVQ(2R)-2-(4-CHLOROPHENYL)-2-PHENYLETHANAMINEA2UW80.71