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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00004699

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
4A34-AMINO-3-HYDROXYBENZOIC ACIDA,B2HDR0.74
BHA2-HYDROXY-4-AMINOBENZOIC ACIDA1PBC0.75
BHA2-HYDROXY-4-AMINOBENZOIC ACIDA1PBF0.75
BHA2-HYDROXY-4-AMINOBENZOIC ACIDA1SXK0.75
3B42-(cyclohexylamino)benzoic acidA,B3B4P0.8
A752-[(PHENYLSULFONYL)AMINO]-5,6,7,8-
TETRAHYDRONAPHTHALENE-1-CARBOXYLIC ACID
A1YW80.74
4BA4-[(2-CARBOXY-ETHYLAMINO)-METHYL]-
BENZOIC ACID
C1FAV0.73
AHC4-AMINOHYDROCINNAMIC ACIDA,B2AY10.78
4AA4-CHLORO-3-HYDROXYANTHRANILIC ACIDA1YFW0.71
4AA4-CHLORO-3-HYDROXYANTHRANILIC ACIDA1YFX0.71
3AB3-aminobenzamideA,B,C,D3GOY0.74
2T12-[({4-[2-(trifluoromethyl)phenyl]piperidin-
1-yl}carbonyl)amino]benzoic acid
A,B3FMZ0.71
C9P4-(dihydroxyboranyl)-2-({[4-(phenylsulfonyl)thiophen-
2-yl]sulfonyl}amino)benzoic acid
A,B3BM60.7
AAN2-(4-NITROPHENYL)ACETIC ACIDB1AJN0.73
8785-IODO-2-(OXALYL-AMINO)-BENZOIC ACIDA1ECV0.78
A842-[({2-[(1Z)-3-(DIMETHYLAMINO)PROP-
1-ENYL]-4-FLUOROPHENYL}SULFONYL)AMINO]-
5,6,7,8-TETRAHYDRONAPHTHALENE-1-
CARBOXYLIC ACID
A1YW90.72
A415-METHYL-2-[(PHENYLSULFONYL)AMINO]BENZOIC ACIDA1YW70.78
4MB4-[(METHYLSULFONYL)AMINO]BENZOIC ACIDA,B2HDS0.78
1371-(O-CARBOXY-PHENYLAMINO)-1-DEOXY-
D-RIBULOSE-5-PHOSPHATE
P1JCM0.7
1371-(O-CARBOXY-PHENYLAMINO)-1-DEOXY-
D-RIBULOSE-5-PHOSPHATE
A1LBM0.7
1371-(O-CARBOXY-PHENYLAMINO)-1-DEOXY-
D-RIBULOSE-5-PHOSPHATE
A1LBL0.7
1371-(O-CARBOXY-PHENYLAMINO)-1-DEOXY-
D-RIBULOSE-5-PHOSPHATE
A1LBF0.7
BE22-AMINOBENZOIC ACIDA,B,C,D,E,F,
G,H
1F8S0.93
BE22-AMINOBENZOIC ACIDE,I1ZFP0.93
BE22-AMINOBENZOIC ACIDA,B2HU80.93
BE22-AMINOBENZOIC ACIDA,B1AN90.93
BE22-AMINOBENZOIC ACIDA,B,C,D2GVQ0.93
BE22-AMINOBENZOIC ACIDA,B2YR60.93
BE22-AMINOBENZOIC ACIDA,I1E8N0.93
BE22-AMINOBENZOIC ACIDA,B,C,D1ZYK0.93
BE22-AMINOBENZOIC ACIDA1C0I0.93
BE22-AMINOBENZOIC ACIDA,B2JB30.93
BE22-AMINOBENZOIC ACIDA,B,C,D2E4A0.93
7613-(OXALYL-AMINO)-NAPHTHALENE-2-
CARBOXYLIC ACID
A1C840.71
3HA3-HYDROXYANTHRANILIC ACIDA,B1U1W0.79
3HA3-HYDROXYANTHRANILIC ACIDA1YFY0.79
4NB4-NITROBENZOIC ACIDA,B3CHT0.77