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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02333092

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
2591-(methylsulfanyl)-4-nitrobenzeneX2RAZ0.77
SANSULFANILAMIDEA1AJ00.78
APBM-AMINOPHENYLBORONIC ACIDA,B3BLS0.7
4NM4-NITROPHENYL METHANETHIOLA,B2VO40.7
MB12-chloro-5-nitrobenzenesulfonamideA2QP60.73
5BM(2Z)-bis{amino[(2-aminophenyl)sulfanyl]methylidene}butanedinitrileA3EQH0.71
NPB3-NITROPHENYLBORONIC ACIDA,B1KDS0.75
AMS3-MERCURI-4-AMINOBENZENESULFONAMIDEA3CA20.77
TNBS-(2,3,6-TRINITROPHENYL)CYSTEINEA,B,C,D,E,F,
G,H
1AQX0.73
LJGN,N'-(iminodiethane-2,1-diyl)bis[4-
amino-N-(2-methylpropyl)benzenesulfonamide]
B3BGB0.7
NBZNITROBENZENEA,B2BMQ0.75
NBZNITROBENZENEA,B3BGU0.75
NIT4-NITROANILINEC,D1RMH0.78
NIT4-NITROANILINEA,B,D,F,G,H,I2IXP0.78
NIT4-NITROANILINEB1VBS0.78
NIT4-NITROANILINEC1V9T0.78
NIT4-NITROANILINEC,D1VBT0.78
NIT4-NITROANILINEB1LOP0.78
NIT4-NITROANILINEC,D1ZKF0.78
NIT4-NITROANILINEB1PIP0.78
AAS3-ACTOXYMERCURI-4-AMINOBENZENESULFONAMIDEA1CZM0.74
PNZP-NITRO-BENZYLAMINEA,D,H2HJ40.71
PNZP-NITRO-BENZYLAMINEA,B2C700.71
TNL2,4,6-TRINITROTOLUENEA1GVR0.72
PNDP-NITROPHENYLHYDRAZINEA,G1JMZ0.73
NINDINITROPHENYLENEA1RSM0.8
NINDINITROPHENYLENEA1GVY0.8
NINDINITROPHENYLENEA1GW10.8
ASR4-AMINOPHENYLARSONIC ACIDA1N4F0.7