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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03215172

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
3NT3-NITROTOLUENEA,B2BMR0.74
3NT3-NITROTOLUENEA,B2HMO0.74
TNL2,4,6-TRINITROTOLUENEA1GVR0.71
APZ4-AMINOPHTHALHYDRAZIDEA1ENU0.74
PNZP-NITRO-BENZYLAMINEA,D,H2HJ40.7
PNZP-NITRO-BENZYLAMINEA,B2C700.7
GW92-chloro-5-nitro-N-phenylbenzamideA,D3E000.73
SHHOCTANEDIOIC ACID HYDROXYAMIDE PHENYLAMIDEA1C3S0.72
SHHOCTANEDIOIC ACID HYDROXYAMIDE PHENYLAMIDEA,B,C3C0Z0.72
SHHOCTANEDIOIC ACID HYDROXYAMIDE PHENYLAMIDEA1T690.72
SHHOCTANEDIOIC ACID HYDROXYAMIDE PHENYLAMIDEA,B,C,D1ZZ10.72
ISNISATINA,B1OJA0.7
ISNISATINA,B2BK50.7
PPNPARA-NITROPHENYLALANINEI1YTJ0.7
NID4-NITRO-INDEN-1-ONEA,B1DOH0.81
AAN2-(4-NITROPHENYL)ACETIC ACIDB1AJN0.74
3AB3-aminobenzamideA,B,C,D3GOY0.87
BVATRIHYDROXY[(N-HYDROXYBENZAMIDATO)OXO]VANADATEB,C2P8O0.79
KY14-(2-AMINOPHENYL)-4-OXOBUTANOIC ACIDA,B,C,D2CH20.72
AHC4-AMINOHYDROCINNAMIC ACIDA,B2AY10.71
CRIA,B1VKG0.76
MNP2-(3-NITROPHENYL)ACETIC ACIDB1AI50.73
4NB4-NITROBENZOIC ACIDA,B3CHT0.72
BHOBENZHYDROXAMIC ACIDA,B1GX20.79
BHOBENZHYDROXAMIC ACIDA1HSR0.79
BHOBENZHYDROXAMIC ACIDA,B2ATJ0.79
BHOBENZHYDROXAMIC ACIDA,B4ATJ0.79
BHOBENZHYDROXAMIC ACIDA,B3ATJ0.79
BHOBENZHYDROXAMIC ACIDA3GCK0.79
BHOBENZHYDROXAMIC ACIDA,B,C,D,E,F,
G,H
2BOY0.79
GAB3-AMINOBENZOIC ACIDA,B,C,D,E,F2PQF0.73
GAB3-AMINOBENZOIC ACIDA,B3GSB0.73
GAB3-AMINOBENZOIC ACIDA,B,C1GBN0.73
GAB3-AMINOBENZOIC ACIDA3FHB0.73
TSNTRICHOSTATIN AA,B1T640.78
TSNTRICHOSTATIN AA,B1C3R0.78
TSNTRICHOSTATIN AA,B,C3F0R0.78
TSNTRICHOSTATIN AA,B,C3C100.78