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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00003071

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
UA5(4-ETHYLPHENYL)SULFAMIC ACIDA,B2I5X0.71
PRY2-PROPYL-ANILINEA1OWY0.78
AMS3-MERCURI-4-AMINOBENZENESULFONAMIDEA3CA20.74
NINDINITROPHENYLENEA1RSM0.78
NINDINITROPHENYLENEA1GVY0.78
NINDINITROPHENYLENEA1GW10.78
ISOPARA-ISOPROPYLANILINEA1BMA0.75
ISOPARA-ISOPROPYLANILINEA,B1ELC0.75
ISOPARA-ISOPROPYLANILINEA,B1ELB0.75
ISOPARA-ISOPROPYLANILINEA,B1ELA0.75
34A3,4-DIMETHYLANILINEA1L4K0.75
APBM-AMINOPHENYLBORONIC ACIDA,B3BLS0.86
NPB3-NITROPHENYLBORONIC ACIDA,B1KDS0.72
1504,5-DIMETHYL-1,2-PHENYLENEDIAMINEA1L4F0.78
U134-(4-FLUORO-PHENYLAZO)-5-IMINO-
5H-PYRAZOL-3-YLAMINE
A2GG30.73
SANSULFANILAMIDEA1AJ00.75
1AN2-FLUOROANILINEA1LGW0.84
BSU1,3-DIPHENYLUREAA3E850.71
BSU1,3-DIPHENYLUREAA2ZJF0.71
PBZP-AMINO BENZAMIDINEA,B2BDG0.74
PBZP-AMINO BENZAMIDINEA1RFN0.74
PBZP-AMINO BENZAMIDINEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P
2BDI0.74
PBZP-AMINO BENZAMIDINEA,B,C,D2BDH0.74
PBZP-AMINO BENZAMIDINEA1FIZ0.74
PBZP-AMINO BENZAMIDINEA1FIW0.74
PBZP-AMINO BENZAMIDINEH,L,T2A2Q0.74
NYLN-ALLYL-ANILINEA1OVK0.76
XYD2,5-DIMETHYLANILINEA,B,C,D1KYA0.77
XYD2,5-DIMETHYLANILINEA1L4L0.77
URSN-PHENYLTHIOUREAA,B1BUG0.75
NIT4-NITROANILINEC,D1RMH0.8
NIT4-NITROANILINEA,B,D,F,G,H,I2IXP0.8
NIT4-NITROANILINEB1VBS0.8
NIT4-NITROANILINEC1V9T0.8
NIT4-NITROANILINEC,D1VBT0.8
NIT4-NITROANILINEB1LOP0.8
NIT4-NITROANILINEC,D1ZKF0.8
NIT4-NITROANILINEB1PIP0.8
NP2N-(3-AMINOPROPYL)-2-NITROBENZENAMINEA1WUM0.72
1MRN-METHYLANILINEX2OTZ0.78
264(phenylamino)acetonitrileA2RBN0.75
DBP1,3-DIAMINOBENZYL PHENYLALANINEA1A850.79
PL01-phenylguanidineA2O8W0.74
NBZNITROBENZENEA,B2BMQ0.74
NBZNITROBENZENEA,B3BGU0.74
NBENITROSOBENZENEA1LH70.78
NBENITROSOBENZENEA2LH70.78
NBENITROSOBENZENEA2NSS0.78
5AN3,5-DIFLUOROANILINEA1LGX0.82
PTU2-ETHYL-1-PHENYL-ISOTHIOUREAA,B1K2T0.73
PTU2-ETHYL-1-PHENYL-ISOTHIOUREAA,B1D1V0.73
ANLANILINEA2OV40.88
ANLANILINEA1AEE0.88
ANLANILINEA1PPA0.88
ANLANILINEA1HJ90.88
PHZ1-PHENYLHYDRAZINEA2E2T0.83
PHZ1-PHENYLHYDRAZINED,H2AGL0.83
ANI4-TRIFLUOROMETHYLANILINEE,I1ELE0.76
ANI4-TRIFLUOROMETHYLANILINEE,I7EST0.76
ANI4-TRIFLUOROMETHYLANILINEE,I2EST0.76
ANI4-TRIFLUOROMETHYLANILINEE,I1ELD0.76
PHJN-[(AMINOOXY)CARBONYL]-N-PHENYLAMINEA,B1UR90.74
FLM3-FLUORO-2-METHYL-ANILINEA1OVJ0.77
PNDP-NITROPHENYLHYDRAZINEA,G1JMZ0.74
ASR4-AMINOPHENYLARSONIC ACIDA1N4F0.86