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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02877913

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
IAP4-IODO-ACETAMIDO PHENYLBORONIC ACIDA1S6R0.72
IAP4-IODO-ACETAMIDO PHENYLBORONIC ACIDA,B1K6S0.72
GP61-(4-AMIDINOPHENYL)-3-(4-CHLOROPHENYL)UREAA1BJU0.77
BSU1,3-DIPHENYLUREAA3E850.82
BSU1,3-DIPHENYLUREAA2ZJF0.82
1MRN-METHYLANILINEX2OTZ0.75
1PP(S)-{[(3R)-5-TERT-BUTYL-2-PHENYL-
2,3-DIHYDRO-1H-PYRAZOL-3-YL]AMINO}[(2,3-
DICHLOROPHENYL)AMINO]METHANOL
A2BAJ0.73
URSN-PHENYLTHIOUREAA,B1BUG0.75
2461-benzyl-3-(2-chloropyridin-4-yl)ureaA2QPM0.72
PL01-phenylguanidineA2O8W0.74
2451-(2-chloropyridin-4-yl)-3-phenylureaA2QKN0.74
CLU2,6-DICHLORO-N-IMIDAZOLIDIN-2-YLIDENEANILINEA,B,D,E2PNC0.76
L10N-[(3Z)-5-TERT-BUTYL-2-PHENYL-1,2-
DIHYDRO-3H-PYRAZOL-3-YLIDENE]-N'-
(4-CHLOROPHENYL)UREA
A1W820.71
RJ1N-[2-chloro-5-(trifluoromethyl)phenyl]imidodicarbonimidic diamideA,B,C,D3DGA0.76
C1M1-(4-CHLOROPHENYL)-2,3-DIHYDRO-
1H-TETRAZOLE
B,I2C900.71
641(3S)-1-CYCLOHEXYL-N-(3,5-DICHLOROPHENYL)-
5-OXOPYRROLIDINE-3-CARBOXAMIDE
A2H7M0.72
CIUN-CYCLOHEXYL-N'-(4-IODOPHENYL)UREAA,B1EK10.83
CIUN-CYCLOHEXYL-N'-(4-IODOPHENYL)UREAA1VJ50.83
PH3N-(CHLOROPHENYL)-N'-HYDROXYGUANIDINEA,B1DM60.81
PHJN-[(AMINOOXY)CARBONYL]-N-PHENYLAMINEA,B1UR90.74
NYLN-ALLYL-ANILINEA1OVK0.77
264(phenylamino)acetonitrileA2RBN0.77