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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02264391

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
NINDINITROPHENYLENEA1RSM0.86
NINDINITROPHENYLENEA1GVY0.86
NINDINITROPHENYLENEA1GW10.86
NPB3-NITROPHENYLBORONIC ACIDA,B1KDS0.89
2591-(methylsulfanyl)-4-nitrobenzeneX2RAZ0.78
PNDP-NITROPHENYLHYDRAZINEA,G1JMZ0.79
ANLANILINEA2OV40.75
ANLANILINEA1AEE0.75
ANLANILINEA1PPA0.75
ANLANILINEA1HJ90.75
5AN3,5-DIFLUOROANILINEA1LGX0.77
ASR4-AMINOPHENYLARSONIC ACIDA1N4F0.76
3NT3-NITROTOLUENEA,B2BMR0.82
3NT3-NITROTOLUENEA,B2HMO0.82
1AN2-FLUOROANILINEA1LGW0.79
4NM4-NITROPHENYL METHANETHIOLA,B2VO40.76
APBM-AMINOPHENYLBORONIC ACIDA,B3BLS0.76
PNZP-NITRO-BENZYLAMINEA,D,H2HJ40.76
PNZP-NITRO-BENZYLAMINEA,B2C700.76
NIT4-NITROANILINEC,D1RMH0.86
NIT4-NITROANILINEA,B,D,F,G,H,I2IXP0.86
NIT4-NITROANILINEB1VBS0.86
NIT4-NITROANILINEC1V9T0.86
NIT4-NITROANILINEC,D1VBT0.86
NIT4-NITROANILINEB1LOP0.86
NIT4-NITROANILINEC,D1ZKF0.86
NIT4-NITROANILINEB1PIP0.86
TNL2,4,6-TRINITROTOLUENEA1GVR0.75
NBENITROSOBENZENEA1LH70.85
NBENITROSOBENZENEA2LH70.85
NBENITROSOBENZENEA2NSS0.85
NBZNITROBENZENEA,B2BMQ0.91
NBZNITROBENZENEA,B3BGU0.91
FLM3-FLUORO-2-METHYL-ANILINEA1OVJ0.7