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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00057405

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
NIT4-NITROANILINEC,D1RMH0.79
NIT4-NITROANILINEA,B,D,F,G,H,I2IXP0.79
NIT4-NITROANILINEB1VBS0.79
NIT4-NITROANILINEC1V9T0.79
NIT4-NITROANILINEC,D1VBT0.79
NIT4-NITROANILINEB1LOP0.79
NIT4-NITROANILINEC,D1ZKF0.79
NIT4-NITROANILINEB1PIP0.79
NPB3-NITROPHENYLBORONIC ACIDA,B1KDS0.74
2591-(methylsulfanyl)-4-nitrobenzeneX2RAZ0.72
PNZP-NITRO-BENZYLAMINEA,D,H2HJ40.7
PNZP-NITRO-BENZYLAMINEA,B2C700.7
I7B4-AMINO-6-CHLOROBENZENE-1,3-DISULFONAMIDEA2POV0.72
AMS3-MERCURI-4-AMINOBENZENESULFONAMIDEA3CA20.75
SANSULFANILAMIDEA1AJ00.75
4NM4-NITROPHENYL METHANETHIOLA,B2VO40.73
NINDINITROPHENYLENEA1RSM0.74
NINDINITROPHENYLENEA1GVY0.74
NINDINITROPHENYLENEA1GW10.74
NBZNITROBENZENEA,B2BMQ0.74
NBZNITROBENZENEA,B3BGU0.74
SDA4-AMINO-3,5-DICHLOROBENZENESULFONAMIDEA1ZGE0.7
AAS3-ACTOXYMERCURI-4-AMINOBENZENESULFONAMIDEA1CZM0.72
PNDP-NITROPHENYLHYDRAZINEA,G1JMZ0.74
MB12-chloro-5-nitrobenzenesulfonamideA2QP60.81