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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00001918

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
4PH4-methyl-L-phenylalanineB,C3BV90.86
4BA4-[(2-CARBOXY-ETHYLAMINO)-METHYL]-
BENZOIC ACID
C1FAV0.73
5PV5-PHENYLVALERIC ACIDA,B2AY90.72
1ZN(2S,3S,4E,6E,8S,9S)-3-amino-9-methoxy-
2,6,8-trimethyl-10-phenyldeca-4,6-
dienoic acid
C,F,M,N2IAE0.75
AAN2-(4-NITROPHENYL)ACETIC ACIDB1AJN0.71
APAAMIDO PHENYL PYRUVIC ACIDH,I1AHT0.73
APAAMIDO PHENYL PYRUVIC ACIDA,B,C,D1A0L0.73
APAAMIDO PHENYL PYRUVIC ACIDA1TPP0.73
4BF4-BROMO-L-PHENYLALANINEA2AG60.79
4AF4-ACETYL-L-PHENYLALANINEA1ZH60.81
2004-CHLORO-L-PHENYLALANINEA,B2AKW0.79
APD3-METHYLPHENYLALANINEA,B,C1GMY0.86
7912-PHENYLMALONIC ACIDA1O4P0.71
AHC4-AMINOHYDROCINNAMIC ACIDA,B2AY10.76
23N(2R)-2-benzyl-3-nitropropanoic acidA2RFH0.71
ALNNAPHTHALEN-2-YL-3-ALANINEA,B,I,J2FIV0.81
ALNNAPHTHALEN-2-YL-3-ALANINEA,B1B0H0.81
ALNNAPHTHALEN-2-YL-3-ALANINEB1FIV0.81
ALNNAPHTHALEN-2-YL-3-ALANINEA,B,I,J3FIV0.81
0A9methyl L-phenylalaninateA1AY20.88
0A9methyl L-phenylalaninateI5ER10.88
0A9methyl L-phenylalaninateI,P1HDT0.88
247(3R)-3-amino-2,2-difluoro-3-(4-
hydroxyphenyl)propanoic acid
A,B2QVE0.74
1PAPHENYLMETHYLACETIC ACID ALANINEI1BHF0.87
059(2S)-2-[3-(AMINOMETHYL)PHENYL]-
3-{(S)-HYDROXY[(1R)-2-METHYL-1-
{[(2-PHENYLETHYL)SULFONYL]AMINO}PROPYL]PHOSPHORYL}PROPANOIC ACID
A2PJ60.7
296(3R)-3-amino-2,2-difluoro-3-(4-
methoxyphenyl)propanoic acid
A,B2RJS0.7
ADD2,6,8-TRIMETHYL-3-AMINO-9-BENZYL-
9-METHOXYNONANOIC ACID
A,B,M,N1FJM0.77
ADD2,6,8-TRIMETHYL-3-AMINO-9-BENZYL-
9-METHOXYNONANOIC ACID
A1EVA0.77
ADD2,6,8-TRIMETHYL-3-AMINO-9-BENZYL-
9-METHOXYNONANOIC ACID
A1LCM0.77
ADD2,6,8-TRIMETHYL-3-AMINO-9-BENZYL-
9-METHOXYNONANOIC ACID
A,B,C,D,E,F,
G,H
2NYM0.77
ADD2,6,8-TRIMETHYL-3-AMINO-9-BENZYL-
9-METHOXYNONANOIC ACID
C,I2IE30.77
ADD2,6,8-TRIMETHYL-3-AMINO-9-BENZYL-
9-METHOXYNONANOIC ACID
C,F,X,Y2NPP0.77
ADD2,6,8-TRIMETHYL-3-AMINO-9-BENZYL-
9-METHOXYNONANOIC ACID
A1EVC0.77
ADD2,6,8-TRIMETHYL-3-AMINO-9-BENZYL-
9-METHOXYNONANOIC ACID
C,F,G,H3DW80.77
ADD2,6,8-TRIMETHYL-3-AMINO-9-BENZYL-
9-METHOXYNONANOIC ACID
A,B,C,D,E,F,
G,H
2NYL0.77
ADD2,6,8-TRIMETHYL-3-AMINO-9-BENZYL-
9-METHOXYNONANOIC ACID
A1EVD0.77
ADD2,6,8-TRIMETHYL-3-AMINO-9-BENZYL-
9-METHOXYNONANOIC ACID
A1EVB0.77