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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02183911

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
NP2N-(3-AMINOPROPYL)-2-NITROBENZENAMINEA1WUM0.75
TNL2,4,6-TRINITROTOLUENEA1GVR0.81
1AN2-FLUOROANILINEA1LGW0.7
PNZP-NITRO-BENZYLAMINEA,D,H2HJ40.78
PNZP-NITRO-BENZYLAMINEA,B2C700.78
ASR4-AMINOPHENYLARSONIC ACIDA1N4F0.76
NBENITROSOBENZENEA1LH70.82
NBENITROSOBENZENEA2LH70.82
NBENITROSOBENZENEA2NSS0.82
4NM4-NITROPHENYL METHANETHIOLA,B2VO40.75
NINDINITROPHENYLENEA1RSM0.92
NINDINITROPHENYLENEA1GVY0.92
NINDINITROPHENYLENEA1GW10.92
NPB3-NITROPHENYLBORONIC ACIDA,B1KDS0.86
NBZNITROBENZENEA,B2BMQ0.88
NBZNITROBENZENEA,B3BGU0.88
ANLANILINEA2OV40.73
ANLANILINEA1AEE0.73
ANLANILINEA1PPA0.73
ANLANILINEA1HJ90.73
PNDP-NITROPHENYLHYDRAZINEA,G1JMZ0.78
APBM-AMINOPHENYLBORONIC ACIDA,B3BLS0.76
2591-(methylsulfanyl)-4-nitrobenzeneX2RAZ0.76
3NT3-NITROTOLUENEA,B2BMR0.79
3NT3-NITROTOLUENEA,B2HMO0.79
NIT4-NITROANILINEC,D1RMH0.85
NIT4-NITROANILINEA,B,D,F,G,H,I2IXP0.85
NIT4-NITROANILINEB1VBS0.85
NIT4-NITROANILINEC1V9T0.85
NIT4-NITROANILINEC,D1VBT0.85
NIT4-NITROANILINEB1LOP0.85
NIT4-NITROANILINEC,D1ZKF0.85
NIT4-NITROANILINEB1PIP0.85