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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00003916

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
AGBN-(1-ADAMANTYL)-N'-(4-GUANIDINOBENZYL)UREAA1EJN0.71
GP61-(4-AMIDINOPHENYL)-3-(4-CHLOROPHENYL)UREAA1BJU0.72
4NDN4-(N,N-DIPHENYLCARBAMOYL)-AMINOGUANIDINEH,I1NO90.78
CIUN-CYCLOHEXYL-N'-(4-IODOPHENYL)UREAA,B1EK10.78
CIUN-CYCLOHEXYL-N'-(4-IODOPHENYL)UREAA1VJ50.78
C1M1-(4-CHLOROPHENYL)-2,3-DIHYDRO-
1H-TETRAZOLE
B,I2C900.7
NP2N-(3-AMINOPROPYL)-2-NITROBENZENAMINEA1WUM0.7
NYLN-ALLYL-ANILINEA1OVK0.81
1JZ1-[4-(hydroxymethyl)phenyl]guanidineB3FVF0.72
4PG1-[4-(2-oxo-2-phenylethyl)phenyl]guanidineU2R2W0.72
264(phenylamino)acetonitrileA2RBN0.81
APBM-AMINOPHENYLBORONIC ACIDA,B3BLS0.74
IAP4-IODO-ACETAMIDO PHENYLBORONIC ACIDA1S6R0.75
IAP4-IODO-ACETAMIDO PHENYLBORONIC ACIDA,B1K6S0.75
1AN2-FLUOROANILINEA1LGW0.73
ASR4-AMINOPHENYLARSONIC ACIDA1N4F0.74
427(R)-1-(4-(4-(HYDROXYMETHYL)-1,3,2-
DIOXABOROLAN-2-YL)PHENYL)GUANIDINE
A1ZMN0.82
ANLANILINEA2OV40.76
ANLANILINEA1AEE0.76
ANLANILINEA1PPA0.76
ANLANILINEA1HJ90.76
5AN3,5-DIFLUOROANILINEA1LGX0.71
BSU1,3-DIPHENYLUREAA3E850.86
BSU1,3-DIPHENYLUREAA2ZJF0.86
1712-PHENYLAMINO-ETHANESULFONIC ACIDA,B1SXG0.7
1MRN-METHYLANILINEX2OTZ0.81