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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03294426

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
TRJMETA-DI(AMINOMETHYL)BENZENEA,I1GVV0.7
TRJMETA-DI(AMINOMETHYL)BENZENEA1FQ50.7
BAMBENZAMIDINEU1F5K0.81
BAMBENZAMIDINEX2BY80.81
BAMBENZAMIDINEB2PSM0.81
BAMBENZAMIDINEX2BY90.81
BAMBENZAMIDINEA1C1N0.81
BAMBENZAMIDINEX2BY60.81
BAMBENZAMIDINEH,I1C5O0.81
BAMBENZAMIDINEA1XX40.81
BAMBENZAMIDINEA1HJ80.81
BAMBENZAMIDINEA1C5P0.81
BAMBENZAMIDINEB1C5Z0.81
BAMBENZAMIDINEA,B1ZVW0.81
BAMBENZAMIDINEA2ANW0.81
BAMBENZAMIDINEA2ANY0.81
BAMBENZAMIDINEX2BYA0.81
BAMBENZAMIDINEA1TIO0.81
BAMBENZAMIDINEX2BY50.81
BAMBENZAMIDINEX2BY70.81
A21(5S)-2-{[(1S)-1-(2-fluorophenyl)ethyl]amino}-
5-methyl-5-(trifluoromethyl)-1,3-
thiazol-4(5H)-one
A,B,C,D3BZU0.71
U125-IMINO-4-(3-TRIFLUOROMETHYL-PHENYLAZO)-
5H-PYRAZOL-3-YLAMINE
A2GG20.72
FBA4-FLUOROBENZYLAMINEB,D,E1AFQ0.71
FBA4-FLUOROBENZYLAMINEA1TNH0.71
BENBENZAMIDINEA2TIO0.81
BENBENZAMIDINEA1J150.81
BENBENZAMIDINEA,B3BEU0.81
BENBENZAMIDINET1V2U0.81
BENBENZAMIDINEA,B,C,D,E,F3CF80.81
BENBENZAMIDINEA1S0R0.81
BENBENZAMIDINEA,B1V160.81
BENBENZAMIDINEA1CC70.81
BENBENZAMIDINEA3BG80.81
BENBENZAMIDINEA1CC80.81
BENBENZAMIDINEA3PTB0.81
BENBENZAMIDINEA,B1TRM0.81
BENBENZAMIDINEA1ZHR0.81
BENBENZAMIDINEA,B,C,D,E,F1NKZ0.81
BENBENZAMIDINEA2BLV0.81
BENBENZAMIDINEA,B,C,D,E,F2GLP0.81
BENBENZAMIDINEH,I3D490.81
BENBENZAMIDINEH,L,T2AER0.81
BENBENZAMIDINEA1J140.81
BENBENZAMIDINEA1NSA0.81
BENBENZAMIDINEA2AYW0.81
BENBENZAMIDINEA1BRA0.81
BENBENZAMIDINEA,B,C,D1A0J0.81
BENBENZAMIDINEB,C,D2AST0.81
BENBENZAMIDINEA,B2CKR0.81
BENBENZAMIDINEA1LPU0.81
BENBENZAMIDINEA1ZHM0.81
BENBENZAMIDINEA1J8A0.81
BENBENZAMIDINEA,B3BCX0.81
BENBENZAMIDINEA,B,C,D,E,F3CF90.81
BENBENZAMIDINEA,B,C,D,E,F3D040.81
BENBENZAMIDINEA,B,C,D,E,F2GLL0.81
BENBENZAMIDINEA1AND0.81
BENBENZAMIDINEA2TBS0.81
BENBENZAMIDINEA,B,C,D,E,F3DP20.81
BENBENZAMIDINET1V2M0.81
BENBENZAMIDINEA2EEK0.81
BENBENZAMIDINEH,I2ZI20.81
BENBENZAMIDINET1V2J0.81
BENBENZAMIDINEH1KLI0.81
BENBENZAMIDINEA1CE50.81
BENBENZAMIDINEA,B,C,D,E,F3B7J0.81
BENBENZAMIDINEB,Y2PKA0.81
BENBENZAMIDINEA2VJ00.81
BENBENZAMIDINEA3B3J0.81
BENBENZAMIDINEA,B,C,D,E,F3DOY0.81
BENBENZAMIDINEA,B,C,D,E,F3DP30.81
BENBENZAMIDINEA,B,C,D,E,F2GLM0.81
BENBENZAMIDINEA1ANB0.81
BENBENZAMIDINEA1LO60.81
BENBENZAMIDINEA1LR40.81
BENBENZAMIDINEA,B1V1M0.81
BENBENZAMIDINEA1ZHP0.81
BENBENZAMIDINEA2J9N0.81
BENBENZAMIDINEA2BMV0.81
BENBENZAMIDINEA,B2CKS0.81
BENBENZAMIDINEA2BLW0.81
BENBENZAMIDINEA1J160.81
BENBENZAMIDINEA,B1V110.81
BENBENZAMIDINEA,B,C,D,E,F3DP00.81
BENBENZAMIDINEB1RTF0.81
BENBENZAMIDINEA,B,C,D,E,F3DP10.81
BENBENZAMIDINEA,B,C,D2E580.81
BENBENZAMIDINEA2TRM0.81
BENBENZAMIDINET1V2V0.81
BENBENZAMIDINEA1MBQ0.81
BENBENZAMIDINEA,B,C,D,E,F3DOZ0.81
BENBENZAMIDINEA2O8U0.81
BENBENZAMIDINEH1DWB0.81
BENBENZAMIDINEB,C2ASS0.81
BENBENZAMIDINEA1ANE0.81
BENBENZAMIDINEH,I2ZIQ0.81
BENBENZAMIDINEA1BIT0.81
BENBENZAMIDINEA2AIQ0.81
BENBENZAMIDINEA2OQ50.81
BENBENZAMIDINEA1ANC0.81
BENBENZAMIDINEH1JBU0.81
BENBENZAMIDINEA,B2BPQ0.81
BENBENZAMIDINEA,B,C,D2GNN0.81
BENBENZAMIDINET1V2S0.81
BENBENZAMIDINEA1H4W0.81
BENBENZAMIDINEA1OSS0.81
BENBENZAMIDINEA1W800.81
BENBENZAMIDINEA1BTY0.81
BENBENZAMIDINEH,I2ZFQ0.81
BENBENZAMIDINEA1EAX0.81
BENBENZAMIDINEA1L2E0.81
BENBENZAMIDINEA1WRI0.81
BENBENZAMIDINEA,B3BB80.81
BENBENZAMIDINEA2OXS0.81
BENBENZAMIDINEA1DPO0.81
BENBENZAMIDINET1V2L0.81
FPA1,1 DIFLUORO-N-PHENYLETHYL ACETAMIDEE,I4EST0.73
PBZP-AMINO BENZAMIDINEA,B2BDG0.71
PBZP-AMINO BENZAMIDINEA1RFN0.71
PBZP-AMINO BENZAMIDINEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P
2BDI0.71
PBZP-AMINO BENZAMIDINEA,B,C,D2BDH0.71
PBZP-AMINO BENZAMIDINEA1FIZ0.71
PBZP-AMINO BENZAMIDINEA1FIW0.71
PBZP-AMINO BENZAMIDINEH,L,T2A2Q0.71
BBA2,7-BIS-(4-AMIDINOBENZYLIDENE)-
CYCLOHEPTAN-1-ONE
A,B1A5H0.71
BBA2,7-BIS-(4-AMIDINOBENZYLIDENE)-
CYCLOHEPTAN-1-ONE
T1V2N0.71
U195-IMINO-4-(2-TRIFLUOROMETHYL-PHENYLAZO)-
5H-PYRAZOL-3-YLAMINE
A2GG50.72
4CM(4-CARBAMIMIDOYLPHENYL)-METHYL-
PHOSPHINIC ACID
A1TX70.75