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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02250424

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
3HA3-HYDROXYANTHRANILIC ACIDA,B1U1W0.75
3HA3-HYDROXYANTHRANILIC ACIDA1YFY0.75
GAB3-AMINOBENZOIC ACIDA,B,C,D,E,F2PQF0.79
GAB3-AMINOBENZOIC ACIDA,B3GSB0.79
GAB3-AMINOBENZOIC ACIDA,B,C1GBN0.79
GAB3-AMINOBENZOIC ACIDA3FHB0.79
135N-(4-CARBAMIMIDOYL-PHENYL)-2-HYDROXY-
BENZAMIDE
B1GJA0.78
MHBA,B1SRG0.8
ST34-(ACETYLAMINO)-3-AMINO BENZOIC ACIDA,B1IVE0.71
3AB3-aminobenzamideA,B,C,D3GOY0.7
DMBA,B1SRI0.78
HNA1,8-DI-HYDROXY-4-NITRO-ANTHRAQUINONEA1M2P0.71
ST24-(ACETYLAMINO)-5-AMINO-3-HYDROXYBENZOIC ACIDA,B1IVC0.71
NABA,B1SRJ0.74
DB12,3-DIHYDROXYBENZAMIDEA,B,C1X710.78
1BA4-HYDROXY-N'-(4-ISOPROPYLBENZYL)BENZOHYDRAZIDEA2GPP0.74
TY23-AMINO-L-TYROSINEA,B2VH30.74
LJ5N-(3,5-dibromo-4-hydroxyphenyl)benzamideA,B3CN40.73
MTBA,B1SRF0.76
LI7(3E)-3-[(4-HYDROXYPHENYL)IMINO]-
1H-INDOL-2(3H)-ONE
A1YXX0.71
HBD4-HYDROXYBENZAMIDEB,C,D1BEN0.75
U143-(5-AMINO-3-IMINO-3H-PYRAZOL-4-
YLAZO)-BENZOIC ACID
A2GG70.72
TYQ3-AMINO-6-HYDROXY-TYROSINEA,B1D6Y0.71
TYQ3-AMINO-6-HYDROXY-TYROSINEA,B1D6U0.71
PAB4-AMINOBENZOIC ACIDA1PBD0.74
PAB4-AMINOBENZOIC ACIDB2DZA0.74
PAB4-AMINOBENZOIC ACIDA1IUS0.74
PAB4-AMINOBENZOIC ACIDA1IUU0.74
PAB4-AMINOBENZOIC ACIDA1IUT0.74
AZY3-AZIDO-L-TYROSINEA2YXN0.73
SHASALICYLHYDROXAMIC ACIDX1V0H0.8
SHASALICYLHYDROXAMIC ACIDA2QPK0.8
SHASALICYLHYDROXAMIC ACIDA3FNL0.8
SHASALICYLHYDROXAMIC ACIDA3GCJ0.8
SHASALICYLHYDROXAMIC ACIDA1CK60.8
BHA2-HYDROXY-4-AMINOBENZOIC ACIDA1PBC0.81
BHA2-HYDROXY-4-AMINOBENZOIC ACIDA1PBF0.81
BHA2-HYDROXY-4-AMINOBENZOIC ACIDA1SXK0.81
SGI3-(4-hydroxyphenyl)propanamideA,B2R9K0.7
2AC2-AMINO-P-CRESOLH,I1A2C0.72
2AC2-AMINO-P-CRESOLA1L4M0.72
SCLACETIC ACID SALICYLOYL-AMINO-ESTERA1EBV0.77
BE22-AMINOBENZOIC ACIDA,B,C,D,E,F,
G,H
1F8S0.75
BE22-AMINOBENZOIC ACIDE,I1ZFP0.75
BE22-AMINOBENZOIC ACIDA,B2HU80.75
BE22-AMINOBENZOIC ACIDA,B1AN90.75
BE22-AMINOBENZOIC ACIDA,B,C,D2GVQ0.75
BE22-AMINOBENZOIC ACIDA,B2YR60.75
BE22-AMINOBENZOIC ACIDA,I1E8N0.75
BE22-AMINOBENZOIC ACIDA,B,C,D1ZYK0.75
BE22-AMINOBENZOIC ACIDA1C0I0.75
BE22-AMINOBENZOIC ACIDA,B2JB30.75
BE22-AMINOBENZOIC ACIDA,B,C,D2E4A0.75
HABA,B1SRE0.79
4A34-AMINO-3-HYDROXYBENZOIC ACIDA,B2HDR0.76
MNY5,8-DI-AMINO-1,4-DIHYDROXY-ANTHRAQUINONEA1M2R0.74