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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02503213

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
FRD1-PHENYL-2-AMINOPROPANEA,C2AOI0.72
FRD1-PHENYL-2-AMINOPROPANEA,B,C2AOF0.72
FRD1-PHENYL-2-AMINOPROPANEA,B,C2AOJ0.72
FRD1-PHENYL-2-AMINOPROPANEA,B,C2AOH0.72
PEA2-PHENYLETHYLAMINEA,B,E,F,G,H1MHW0.75
PEA2-PHENYLETHYLAMINEA1TNJ0.75
PEA2-PHENYLETHYLAMINED,H2HKM0.75
PEA2-PHENYLETHYLAMINEA1UTO0.75
PEA2-PHENYLETHYLAMINEA,B1D6Y0.75
PEA2-PHENYLETHYLAMINEA,B1D6Z0.75
PEA2-PHENYLETHYLAMINEA,B1D6U0.75
PEA2-PHENYLETHYLAMINEA1UTM0.75
BENBENZAMIDINEA2TIO0.77
BENBENZAMIDINEA1J150.77
BENBENZAMIDINEA,B3BEU0.77
BENBENZAMIDINET1V2U0.77
BENBENZAMIDINEA,B,C,D,E,F3CF80.77
BENBENZAMIDINEA1S0R0.77
BENBENZAMIDINEA,B1V160.77
BENBENZAMIDINEA1CC70.77
BENBENZAMIDINEA3BG80.77
BENBENZAMIDINEA1CC80.77
BENBENZAMIDINEA3PTB0.77
BENBENZAMIDINEA,B1TRM0.77
BENBENZAMIDINEA1ZHR0.77
BENBENZAMIDINEA,B,C,D,E,F1NKZ0.77
BENBENZAMIDINEA2BLV0.77
BENBENZAMIDINEA,B,C,D,E,F2GLP0.77
BENBENZAMIDINEH,I3D490.77
BENBENZAMIDINEH,L,T2AER0.77
BENBENZAMIDINEA1J140.77
BENBENZAMIDINEA1NSA0.77
BENBENZAMIDINEA2AYW0.77
BENBENZAMIDINEA1BRA0.77
BENBENZAMIDINEA,B,C,D1A0J0.77
BENBENZAMIDINEB,C,D2AST0.77
BENBENZAMIDINEA,B2CKR0.77
BENBENZAMIDINEA1LPU0.77
BENBENZAMIDINEA1ZHM0.77
BENBENZAMIDINEA1J8A0.77
BENBENZAMIDINEA,B3BCX0.77
BENBENZAMIDINEA,B,C,D,E,F3CF90.77
BENBENZAMIDINEA,B,C,D,E,F3D040.77
BENBENZAMIDINEA,B,C,D,E,F2GLL0.77
BENBENZAMIDINEA1AND0.77
BENBENZAMIDINEA2TBS0.77
BENBENZAMIDINEA,B,C,D,E,F3DP20.77
BENBENZAMIDINET1V2M0.77
BENBENZAMIDINEA2EEK0.77
BENBENZAMIDINEH,I2ZI20.77
BENBENZAMIDINET1V2J0.77
BENBENZAMIDINEH1KLI0.77
BENBENZAMIDINEA1CE50.77
BENBENZAMIDINEA,B,C,D,E,F3B7J0.77
BENBENZAMIDINEB,Y2PKA0.77
BENBENZAMIDINEA2VJ00.77
BENBENZAMIDINEA3B3J0.77
BENBENZAMIDINEA,B,C,D,E,F3DOY0.77
BENBENZAMIDINEA,B,C,D,E,F3DP30.77
BENBENZAMIDINEA,B,C,D,E,F2GLM0.77
BENBENZAMIDINEA1ANB0.77
BENBENZAMIDINEA1LO60.77
BENBENZAMIDINEA1LR40.77
BENBENZAMIDINEA,B1V1M0.77
BENBENZAMIDINEA1ZHP0.77
BENBENZAMIDINEA2J9N0.77
BENBENZAMIDINEA2BMV0.77
BENBENZAMIDINEA,B2CKS0.77
BENBENZAMIDINEA2BLW0.77
BENBENZAMIDINEA1J160.77
BENBENZAMIDINEA,B1V110.77
BENBENZAMIDINEA,B,C,D,E,F3DP00.77
BENBENZAMIDINEB1RTF0.77
BENBENZAMIDINEA,B,C,D,E,F3DP10.77
BENBENZAMIDINEA,B,C,D2E580.77
BENBENZAMIDINEA2TRM0.77
BENBENZAMIDINET1V2V0.77
BENBENZAMIDINEA1MBQ0.77
BENBENZAMIDINEA,B,C,D,E,F3DOZ0.77
BENBENZAMIDINEA2O8U0.77
BENBENZAMIDINEH1DWB0.77
BENBENZAMIDINEB,C2ASS0.77
BENBENZAMIDINEA1ANE0.77
BENBENZAMIDINEH,I2ZIQ0.77
BENBENZAMIDINEA1BIT0.77
BENBENZAMIDINEA2AIQ0.77
BENBENZAMIDINEA2OQ50.77
BENBENZAMIDINEA1ANC0.77
BENBENZAMIDINEH1JBU0.77
BENBENZAMIDINEA,B2BPQ0.77
BENBENZAMIDINEA,B,C,D2GNN0.77
BENBENZAMIDINET1V2S0.77
BENBENZAMIDINEA1H4W0.77
BENBENZAMIDINEA1OSS0.77
BENBENZAMIDINEA1W800.77
BENBENZAMIDINEA1BTY0.77
BENBENZAMIDINEH,I2ZFQ0.77
BENBENZAMIDINEA1EAX0.77
BENBENZAMIDINEA1L2E0.77
BENBENZAMIDINEA1WRI0.77
BENBENZAMIDINEA,B3BB80.77
BENBENZAMIDINEA2OXS0.77
BENBENZAMIDINEA1DPO0.77
BENBENZAMIDINET1V2L0.77
L134-AMINO-5-(2-METHYLPHENYL)-2,4-
DIHYDRO-3H-1,2,4-TRIAZOLE-3-THIONE
A2HB90.7
BZZBENZYLHYDRAZINEA,B2E2V0.77
BRNBERENILA,B268D0.72
BRNBERENILA,B1D630.72
BRNBERENILA,D,E2GBY0.72
BRNBERENILA2DBE0.72
BRNBERENILA2GVR0.72
BAMBENZAMIDINEU1F5K0.77
BAMBENZAMIDINEX2BY80.77
BAMBENZAMIDINEB2PSM0.77
BAMBENZAMIDINEX2BY90.77
BAMBENZAMIDINEA1C1N0.77
BAMBENZAMIDINEX2BY60.77
BAMBENZAMIDINEH,I1C5O0.77
BAMBENZAMIDINEA1XX40.77
BAMBENZAMIDINEA1HJ80.77
BAMBENZAMIDINEA1C5P0.77
BAMBENZAMIDINEB1C5Z0.77
BAMBENZAMIDINEA,B1ZVW0.77
BAMBENZAMIDINEA2ANW0.77
BAMBENZAMIDINEA2ANY0.77
BAMBENZAMIDINEX2BYA0.77
BAMBENZAMIDINEA1TIO0.77
BAMBENZAMIDINEX2BY50.77
BAMBENZAMIDINEX2BY70.77
B2FPHENYLALANINE BORONIC ACIDA,P1GBM0.76
B2FPHENYLALANINE BORONIC ACIDA,P1GBD0.76
B2FPHENYLALANINE BORONIC ACIDA,P1P060.76
B2FPHENYLALANINE BORONIC ACIDA,P1GBI0.76
B2FPHENYLALANINE BORONIC ACIDA,P8LPR0.76
PRA3-PHENYLPROPYLAMINEA1TNK0.73
PRA3-PHENYLPROPYLAMINEM1UTL0.73
PBN4-PHENYLBUTYLAMINEA1TNI0.73
PBN4-PHENYLBUTYLAMINEA1UTP0.73
4CM(4-CARBAMIMIDOYLPHENYL)-METHYL-
PHOSPHINIC ACID
A1TX70.73
PPH[(1R)-1-amino-2-phenylethyl]phosphonic acidA1OS00.7
PPH[(1R)-1-amino-2-phenylethyl]phosphonic acidE,I4TMN0.7
PPH[(1R)-1-amino-2-phenylethyl]phosphonic acidS1CGH0.7
PO01-BENZYL-(R)-PROPYLAMINEA,I1LZQ0.72
PO01-BENZYL-(R)-PROPYLAMINEB,I1M0B0.72