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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02349961

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
TNL2,4,6-TRINITROTOLUENEA1GVR0.81
5AN3,5-DIFLUOROANILINEA1LGX0.74
PHJN-[(AMINOOXY)CARBONYL]-N-PHENYLAMINEA,B1UR90.71
ASR4-AMINOPHENYLARSONIC ACIDA1N4F0.8
DBP1,3-DIAMINOBENZYL PHENYLALANINEA1A850.7
AMS3-MERCURI-4-AMINOBENZENESULFONAMIDEA3CA20.72
NBENITROSOBENZENEA1LH70.82
NBENITROSOBENZENEA2LH70.82
NBENITROSOBENZENEA2NSS0.82
NINDINITROPHENYLENEA1RSM0.92
NINDINITROPHENYLENEA1GVY0.92
NINDINITROPHENYLENEA1GW10.92
4NM4-NITROPHENYL METHANETHIOLA,B2VO40.73
PHZ1-PHENYLHYDRAZINEA2E2T0.73
PHZ1-PHENYLHYDRAZINED,H2AGL0.73
NPB3-NITROPHENYLBORONIC ACIDA,B1KDS0.86
NBZNITROBENZENEA,B2BMQ0.88
NBZNITROBENZENEA,B3BGU0.88
ANLANILINEA2OV40.79
ANLANILINEA1AEE0.79
ANLANILINEA1PPA0.79
ANLANILINEA1HJ90.79
SANSULFANILAMIDEA1AJ00.71
2591-(methylsulfanyl)-4-nitrobenzeneX2RAZ0.76
1AN2-FLUOROANILINEA1LGW0.76
IAP4-IODO-ACETAMIDO PHENYLBORONIC ACIDA1S6R0.71
IAP4-IODO-ACETAMIDO PHENYLBORONIC ACIDA,B1K6S0.71
NIT4-NITROANILINEC,D1RMH0.92
NIT4-NITROANILINEA,B,D,F,G,H,I2IXP0.92
NIT4-NITROANILINEB1VBS0.92
NIT4-NITROANILINEC1V9T0.92
NIT4-NITROANILINEC,D1VBT0.92
NIT4-NITROANILINEB1LOP0.92
NIT4-NITROANILINEC,D1ZKF0.92
NIT4-NITROANILINEB1PIP0.92
NP2N-(3-AMINOPROPYL)-2-NITROBENZENAMINEA1WUM0.76
3NT3-NITROTOLUENEA,B2BMR0.79
3NT3-NITROTOLUENEA,B2HMO0.79
PNDP-NITROPHENYLHYDRAZINEA,G1JMZ0.84
APBM-AMINOPHENYLBORONIC ACIDA,B3BLS0.8
PNZP-NITRO-BENZYLAMINEA,D,H2HJ40.8
PNZP-NITRO-BENZYLAMINEA,B2C700.8