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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02130382

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
3NT3-NITROTOLUENEA,B2BMR0.84
3NT3-NITROTOLUENEA,B2HMO0.84
NPB3-NITROPHENYLBORONIC ACIDA,B1KDS0.74
MB12-chloro-5-nitrobenzenesulfonamideA2QP60.74
2591-(methylsulfanyl)-4-nitrobenzeneX2RAZ0.78
TNL2,4,6-TRINITROTOLUENEA1GVR0.79
AMS3-MERCURI-4-AMINOBENZENESULFONAMIDEA3CA20.75
I7C4-AMINO-6-(TRIFLUOROMETHYL)BENZENE-
1,3-DISULFONAMIDE
A2POW0.75
SANSULFANILAMIDEA1AJ00.74
N2M5-AMINO-NAPHTALENE-2-MONOSULFONATEC,D1HKN0.72
NINDINITROPHENYLENEA1RSM0.74
NINDINITROPHENYLENEA1GVY0.74
NINDINITROPHENYLENEA1GW10.74
UA5(4-ETHYLPHENYL)SULFAMIC ACIDA,B2I5X0.7
PNZP-NITRO-BENZYLAMINEA,D,H2HJ40.79
PNZP-NITRO-BENZYLAMINEA,B2C700.79
NBZNITROBENZENEA,B2BMQ0.74
NBZNITROBENZENEA,B3BGU0.74
5NS5-aminonaphthalene-1-sulfonic acidA,B3CFT0.73
AAS3-ACTOXYMERCURI-4-AMINOBENZENESULFONAMIDEA1CZM0.7
NIT4-NITROANILINEC,D1RMH0.74
NIT4-NITROANILINEA,B,D,F,G,H,I2IXP0.74
NIT4-NITROANILINEB1VBS0.74
NIT4-NITROANILINEC1V9T0.74
NIT4-NITROANILINEC,D1VBT0.74
NIT4-NITROANILINEB1LOP0.74
NIT4-NITROANILINEC,D1ZKF0.74
NIT4-NITROANILINEB1PIP0.74
4NM4-NITROPHENYL METHANETHIOLA,B2VO40.8