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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03264021

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
ISOPARA-ISOPROPYLANILINEA1BMA0.75
ISOPARA-ISOPROPYLANILINEA,B1ELC0.75
ISOPARA-ISOPROPYLANILINEA,B1ELB0.75
ISOPARA-ISOPROPYLANILINEA,B1ELA0.75
NIT4-NITROANILINEC,D1RMH0.94
NIT4-NITROANILINEA,B,D,F,G,H,I2IXP0.94
NIT4-NITROANILINEB1VBS0.94
NIT4-NITROANILINEC1V9T0.94
NIT4-NITROANILINEC,D1VBT0.94
NIT4-NITROANILINEB1LOP0.94
NIT4-NITROANILINEC,D1ZKF0.94
NIT4-NITROANILINEB1PIP0.94
NP2N-(3-AMINOPROPYL)-2-NITROBENZENAMINEA1WUM0.73
4NM4-NITROPHENYL METHANETHIOLA,B2VO40.72
5AN3,5-DIFLUOROANILINEA1LGX0.84
SANSULFANILAMIDEA1AJ00.77
34A3,4-DIMETHYLANILINEA1L4K0.75
NPB3-NITROPHENYLBORONIC ACIDA,B1KDS0.85
PRY2-PROPYL-ANILINEA1OWY0.77
1MRN-METHYLANILINEX2OTZ0.77
U134-(4-FLUORO-PHENYLAZO)-5-IMINO-
5H-PYRAZOL-3-YLAMINE
A2GG30.73
2591-(methylsulfanyl)-4-nitrobenzeneX2RAZ0.74
NYLN-ALLYL-ANILINEA1OVK0.76
FLM3-FLUORO-2-METHYL-ANILINEA1OVJ0.76
ANI4-TRIFLUOROMETHYLANILINEE,I1ELE0.77
ANI4-TRIFLUOROMETHYLANILINEE,I7EST0.77
ANI4-TRIFLUOROMETHYLANILINEE,I2EST0.77
ANI4-TRIFLUOROMETHYLANILINEE,I1ELD0.77
URSN-PHENYLTHIOUREAA,B1BUG0.75
ASR4-AMINOPHENYLARSONIC ACIDA1N4F0.88
NINDINITROPHENYLENEA1RSM0.84
NINDINITROPHENYLENEA1GVY0.84
NINDINITROPHENYLENEA1GW10.84
PBZP-AMINO BENZAMIDINEA,B2BDG0.73
PBZP-AMINO BENZAMIDINEA1RFN0.73
PBZP-AMINO BENZAMIDINEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P
2BDI0.73
PBZP-AMINO BENZAMIDINEA,B,C,D2BDH0.73
PBZP-AMINO BENZAMIDINEA1FIZ0.73
PBZP-AMINO BENZAMIDINEA1FIW0.73
PBZP-AMINO BENZAMIDINEH,L,T2A2Q0.73
NBZNITROBENZENEA,B2BMQ0.87
NBZNITROBENZENEA,B3BGU0.87
AMS3-MERCURI-4-AMINOBENZENESULFONAMIDEA3CA20.78
3NT3-NITROTOLUENEA,B2BMR0.78
3NT3-NITROTOLUENEA,B2HMO0.78
1504,5-DIMETHYL-1,2-PHENYLENEDIAMINEA1L4F0.72
264(phenylamino)acetonitrileA2RBN0.75
BSU1,3-DIPHENYLUREAA3E850.73
BSU1,3-DIPHENYLUREAA2ZJF0.73
PNZP-NITRO-BENZYLAMINEA,D,H2HJ40.79
PNZP-NITRO-BENZYLAMINEA,B2C700.79
DBP1,3-DIAMINOBENZYL PHENYLALANINEA1A850.79
PL01-phenylguanidineA2O8W0.74
PNDP-NITROPHENYLHYDRAZINEA,G1JMZ0.86
IAP4-IODO-ACETAMIDO PHENYLBORONIC ACIDA1S6R0.71
IAP4-IODO-ACETAMIDO PHENYLBORONIC ACIDA,B1K6S0.71
1AN2-FLUOROANILINEA1LGW0.87
APBM-AMINOPHENYLBORONIC ACIDA,B3BLS0.88
PHZ1-PHENYLHYDRAZINEA2E2T0.83
PHZ1-PHENYLHYDRAZINED,H2AGL0.83
PTU2-ETHYL-1-PHENYL-ISOTHIOUREAA,B1K2T0.72
PTU2-ETHYL-1-PHENYL-ISOTHIOUREAA,B1D1V0.72
UA5(4-ETHYLPHENYL)SULFAMIC ACIDA,B2I5X0.73
XYD2,5-DIMETHYLANILINEA,B,C,D1KYA0.76
XYD2,5-DIMETHYLANILINEA1L4L0.76
PHJN-[(AMINOOXY)CARBONYL]-N-PHENYLAMINEA,B1UR90.75
NBENITROSOBENZENEA1LH70.93
NBENITROSOBENZENEA2LH70.93
NBENITROSOBENZENEA2NSS0.93
TNL2,4,6-TRINITROTOLUENEA1GVR0.74
ANLANILINEA2OV40.9
ANLANILINEA1AEE0.9
ANLANILINEA1PPA0.9
ANLANILINEA1HJ90.9