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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00017561

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
EAL1-((2S)-2-{[(1S)-1-CARBOXY-3-PHENYLPROPYL]AMINO}PROPANOYL)-
L-PROLINE
A1UZE0.71
APD3-METHYLPHENYLALANINEA,B,C1GMY0.81
2004-CHLORO-L-PHENYLALANINEA,B2AKW0.74
4AF4-ACETYL-L-PHENYLALANINEA1ZH60.75
FCL3-CHLORO-L-PHENYLALANINEE,F1OKW0.74
ALNNAPHTHALEN-2-YL-3-ALANINEA,B,I,J2FIV0.77
ALNNAPHTHALEN-2-YL-3-ALANINEA,B1B0H0.77
ALNNAPHTHALEN-2-YL-3-ALANINEB1FIV0.77
ALNNAPHTHALEN-2-YL-3-ALANINEA,B,I,J3FIV0.77
APMM-AMIDINOPHENYL-3-ALANINEE1PPH0.73
4PH4-methyl-L-phenylalanineB,C3BV90.81
ADD2,6,8-TRIMETHYL-3-AMINO-9-BENZYL-
9-METHOXYNONANOIC ACID
A,B,M,N1FJM0.73
ADD2,6,8-TRIMETHYL-3-AMINO-9-BENZYL-
9-METHOXYNONANOIC ACID
A1EVA0.73
ADD2,6,8-TRIMETHYL-3-AMINO-9-BENZYL-
9-METHOXYNONANOIC ACID
A1LCM0.73
ADD2,6,8-TRIMETHYL-3-AMINO-9-BENZYL-
9-METHOXYNONANOIC ACID
A,B,C,D,E,F,
G,H
2NYM0.73
ADD2,6,8-TRIMETHYL-3-AMINO-9-BENZYL-
9-METHOXYNONANOIC ACID
C,I2IE30.73
ADD2,6,8-TRIMETHYL-3-AMINO-9-BENZYL-
9-METHOXYNONANOIC ACID
C,F,X,Y2NPP0.73
ADD2,6,8-TRIMETHYL-3-AMINO-9-BENZYL-
9-METHOXYNONANOIC ACID
A1EVC0.73
ADD2,6,8-TRIMETHYL-3-AMINO-9-BENZYL-
9-METHOXYNONANOIC ACID
C,F,G,H3DW80.73
ADD2,6,8-TRIMETHYL-3-AMINO-9-BENZYL-
9-METHOXYNONANOIC ACID
A,B,C,D,E,F,
G,H
2NYL0.73
ADD2,6,8-TRIMETHYL-3-AMINO-9-BENZYL-
9-METHOXYNONANOIC ACID
A1EVD0.73
ADD2,6,8-TRIMETHYL-3-AMINO-9-BENZYL-
9-METHOXYNONANOIC ACID
A1EVB0.73
BR46-PHENYL-4(R)-(7-PHENYL-HEPTANOYLAMINO)-
HEXANOIC ACID
A1KQU0.73
0A9methyl L-phenylalaninateA1AY20.8
0A9methyl L-phenylalaninateI5ER10.8
0A9methyl L-phenylalaninateI,P1HDT0.8
4BF4-BROMO-L-PHENYLALANINEA2AG60.74
1PAPHENYLMETHYLACETIC ACID ALANINEI1BHF0.8
DPND-PHENYLALANINEP1MCS0.81
DPND-PHENYLALANINEA1GOE0.81
DPND-PHENYLALANINEA2RM90.81
DPND-PHENYLALANINEA1SOC0.81
DPND-PHENYLALANINEB,C,E,F1SFQ0.81
DPND-PHENYLALANINEI1ABJ0.81
DPND-PHENYLALANINEP1DWE0.81
DPND-PHENYLALANINEI,M1HLT0.81
DPND-PHENYLALANINEA,H,L1J9C0.81
DPND-PHENYLALANINEI,T1TMB0.81
DPND-PHENYLALANINEA2JRY0.81
DPND-PHENYLALANINEA2SOC0.81
DPND-PHENYLALANINEA2YYF0.81
DPND-PHENYLALANINEI2HGT0.81
DPND-PHENYLALANINEA,D2Q3I0.81
DPND-PHENYLALANINEA,P1MCD0.81
DPND-PHENYLALANINEP1HAO0.81
DPND-PHENYLALANINEA,B,I1Z8J0.81
DPND-PHENYLALANINEA,B,C2PGQ0.81
DPND-PHENYLALANINEC,D,H,I,L,M,
X,Y
1DVA0.81
DPND-PHENYLALANINEP1NRR0.81
DPND-PHENYLALANINEI1PPB0.81
DPND-PHENYLALANINEC,D,G,H1NU70.81
DPND-PHENYLALANINEI2HPP0.81
DPND-PHENYLALANINEB,C2OD30.81
DPND-PHENYLALANINEA1B0Q0.81
DPND-PHENYLALANINEB,C,E,F1NU90.81
DPND-PHENYLALANINEA,B,I1Z8I0.81
DPND-PHENYLALANINEH,I,J1TMU0.81
DPND-PHENYLALANINEA,B,C,D,E,F2DNS0.81
DPND-PHENYLALANINEA1GO90.81
DPND-PHENYLALANINEB,C,E,F1A0H0.81
DPND-PHENYLALANINEP1MCF0.81
DPND-PHENYLALANINEA2RME0.81
DPND-PHENYLALANINEH,I1TMT0.81
DPND-PHENYLALANINEI1ABI0.81
DPND-PHENYLALANINER1NRQ0.81
DPND-PHENYLALANINEB,C,F,G2A1D0.81
DPND-PHENYLALANINEA,B2Q330.81
DPND-PHENYLALANINEC,H,L1DAN0.81
DPND-PHENYLALANINEP1MCE0.81
DPND-PHENYLALANINEB,C,E,F2A450.81
DPND-PHENYLALANINEA2RMI0.81
DPND-PHENYLALANINEA,B,I1TQ70.81
DPND-PHENYLALANINEA1W7M0.81
DPND-PHENYLALANINEP1HAP0.81
DPND-PHENYLALANINEA,B1ORF0.81
DPND-PHENYLALANINEI1IHS0.81
DPND-PHENYLALANINEP1MCC0.81
DPND-PHENYLALANINEA2RMD0.81
DPND-PHENYLALANINEA2JQB0.81
DPND-PHENYLALANINEI2HPQ0.81
DPND-PHENYLALANINEC,E,F1SHH0.81
DPND-PHENYLALANINEA,I1CVR0.81
DPND-PHENYLALANINEL,P1AUT0.81
DPND-PHENYLALANINEP1MCI0.81
DPND-PHENYLALANINEH,I3F6U0.81
DPND-PHENYLALANINEA1BFW0.81
DPND-PHENYLALANINEH,I1HAI0.81
DPND-PHENYLALANINEB,C2THF0.81
DPND-PHENYLALANINEI1IHT0.81
DPND-PHENYLALANINEA,P1MCJ0.81
DPND-PHENYLALANINEA1TKH0.81
DPND-PHENYLALANINEC,H,L,T2FIR0.81
DPND-PHENYLALANINEA2FMZ0.81
DPND-PHENYLALANINEA1YL90.81
DPND-PHENYLALANINEI1HUT0.81
DPND-PHENYLALANINEI1FXY0.81
DPND-PHENYLALANINEA1YL80.81
DPND-PHENYLALANINEC,H,L1QFK0.81
DPND-PHENYLALANINEP1MCB0.81
23N(2R)-2-benzyl-3-nitropropanoic acidA2RFH0.71
APHP-AMIDINOPHENYL-3-ALANINEE,I1PPC0.73
APHP-AMIDINOPHENYL-3-ALANINEH1ETS0.73
APHP-AMIDINOPHENYL-3-ALANINEH1ETT0.73
APHP-AMIDINOPHENYL-3-ALANINEI1QUR0.73
BIF(R)-2-AMINO-3-(4-PHENYLCYCLOHEXYL)PROPANOIC ACIDG,M,P,S1YYL0.8
BIF(R)-2-AMINO-3-(4-PHENYLCYCLOHEXYL)PROPANOIC ACIDG,M,P,S2I5Y0.8
CXAPHENYLALANINE-N-SULFONAMIDEA1IY70.79
BEY(2S)-3-[(R)-[(1S)-1-amino-3-phenylpropyl](hydroxy)phosphoryl]-
2-benzylpropanoic acid
A3EBI0.72