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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02424176

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
DBP1,3-DIAMINOBENZYL PHENYLALANINEA1A850.72
1AN2-FLUOROANILINEA1LGW0.72
U134-(4-FLUORO-PHENYLAZO)-5-IMINO-
5H-PYRAZOL-3-YLAMINE
A2GG30.7
URSN-PHENYLTHIOUREAA,B1BUG0.72
CLU2,6-DICHLORO-N-IMIDAZOLIDIN-2-YLIDENEANILINEA,B,D,E2PNC0.7
264(phenylamino)acetonitrileA2RBN0.76
ANLANILINEA2OV40.74
ANLANILINEA1AEE0.74
ANLANILINEA1PPA0.74
ANLANILINEA1HJ90.74
5AN3,5-DIFLUOROANILINEA1LGX0.7
NYLN-ALLYL-ANILINEA1OVK0.76
1712-PHENYLAMINO-ETHANESULFONIC ACIDA,B1SXG0.71
APBM-AMINOPHENYLBORONIC ACIDA,B3BLS0.73
TPM2-(4-AMINOBENZYLAMINO)-3,4,5,6-
TETRAHYDROPYRIDINIUM
J,K,L1F3D0.72
1MRN-METHYLANILINEX2OTZ0.78
PRY2-PROPYL-ANILINEA1OWY0.71
PHZ1-PHENYLHYDRAZINEA2E2T0.71
PHZ1-PHENYLHYDRAZINED,H2AGL0.71
PL01-phenylguanidineA2O8W0.75
ASR4-AMINOPHENYLARSONIC ACIDA1N4F0.73
ZMG(5R)-2-[(2-fluorophenyl)amino]-
5-(1-methylethyl)-1,3-thiazol-4(5H)-
one
A,B,C,D2RBE0.73
PTU2-ETHYL-1-PHENYL-ISOTHIOUREAA,B1K2T0.91
PTU2-ETHYL-1-PHENYL-ISOTHIOUREAA,B1D1V0.91
TFMS-ETHYL-N-[4-(TRIFLUOROMETHYL)PHENYL]ISOTHIOUREAA,B1K2U0.8