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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02196553

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
B2Y1-biphenyl-2-ylmethanamineA,B,C,D3CCB0.73
BAMBENZAMIDINEU1F5K0.87
BAMBENZAMIDINEX2BY80.87
BAMBENZAMIDINEB2PSM0.87
BAMBENZAMIDINEX2BY90.87
BAMBENZAMIDINEA1C1N0.87
BAMBENZAMIDINEX2BY60.87
BAMBENZAMIDINEH,I1C5O0.87
BAMBENZAMIDINEA1XX40.87
BAMBENZAMIDINEA1HJ80.87
BAMBENZAMIDINEA1C5P0.87
BAMBENZAMIDINEB1C5Z0.87
BAMBENZAMIDINEA,B1ZVW0.87
BAMBENZAMIDINEA2ANW0.87
BAMBENZAMIDINEA2ANY0.87
BAMBENZAMIDINEX2BYA0.87
BAMBENZAMIDINEA1TIO0.87
BAMBENZAMIDINEX2BY50.87
BAMBENZAMIDINEX2BY70.87
L134-AMINO-5-(2-METHYLPHENYL)-2,4-
DIHYDRO-3H-1,2,4-TRIAZOLE-3-THIONE
A2HB90.75
745TRANS-6-(2-PHENYLCYCLOPROPYL)-NAPHTHALENE-
2-CARBOXAMIDINE
A1U6Q0.75
SBZ[4-(1,3,2-DIOXABOROLAN-2-YLOXY)METHYL]BENZAMIDINEA1S850.7
TRJMETA-DI(AMINOMETHYL)BENZENEA,I1GVV0.73
TRJMETA-DI(AMINOMETHYL)BENZENEA1FQ50.73
BBA2,7-BIS-(4-AMIDINOBENZYLIDENE)-
CYCLOHEPTAN-1-ONE
A,B1A5H0.75
BBA2,7-BIS-(4-AMIDINOBENZYLIDENE)-
CYCLOHEPTAN-1-ONE
T1V2N0.75
BZZBENZYLHYDRAZINEA,B2E2V0.8
BENBENZAMIDINEA2TIO0.87
BENBENZAMIDINEA1J150.87
BENBENZAMIDINEA,B3BEU0.87
BENBENZAMIDINET1V2U0.87
BENBENZAMIDINEA,B,C,D,E,F3CF80.87
BENBENZAMIDINEA1S0R0.87
BENBENZAMIDINEA,B1V160.87
BENBENZAMIDINEA1CC70.87
BENBENZAMIDINEA3BG80.87
BENBENZAMIDINEA1CC80.87
BENBENZAMIDINEA3PTB0.87
BENBENZAMIDINEA,B1TRM0.87
BENBENZAMIDINEA1ZHR0.87
BENBENZAMIDINEA,B,C,D,E,F1NKZ0.87
BENBENZAMIDINEA2BLV0.87
BENBENZAMIDINEA,B,C,D,E,F2GLP0.87
BENBENZAMIDINEH,I3D490.87
BENBENZAMIDINEH,L,T2AER0.87
BENBENZAMIDINEA1J140.87
BENBENZAMIDINEA1NSA0.87
BENBENZAMIDINEA2AYW0.87
BENBENZAMIDINEA1BRA0.87
BENBENZAMIDINEA,B,C,D1A0J0.87
BENBENZAMIDINEB,C,D2AST0.87
BENBENZAMIDINEA,B2CKR0.87
BENBENZAMIDINEA1LPU0.87
BENBENZAMIDINEA1ZHM0.87
BENBENZAMIDINEA1J8A0.87
BENBENZAMIDINEA,B3BCX0.87
BENBENZAMIDINEA,B,C,D,E,F3CF90.87
BENBENZAMIDINEA,B,C,D,E,F3D040.87
BENBENZAMIDINEA,B,C,D,E,F2GLL0.87
BENBENZAMIDINEA1AND0.87
BENBENZAMIDINEA2TBS0.87
BENBENZAMIDINEA,B,C,D,E,F3DP20.87
BENBENZAMIDINET1V2M0.87
BENBENZAMIDINEA2EEK0.87
BENBENZAMIDINEH,I2ZI20.87
BENBENZAMIDINET1V2J0.87
BENBENZAMIDINEH1KLI0.87
BENBENZAMIDINEA1CE50.87
BENBENZAMIDINEA,B,C,D,E,F3B7J0.87
BENBENZAMIDINEB,Y2PKA0.87
BENBENZAMIDINEA2VJ00.87
BENBENZAMIDINEA3B3J0.87
BENBENZAMIDINEA,B,C,D,E,F3DOY0.87
BENBENZAMIDINEA,B,C,D,E,F3DP30.87
BENBENZAMIDINEA,B,C,D,E,F2GLM0.87
BENBENZAMIDINEA1ANB0.87
BENBENZAMIDINEA1LO60.87
BENBENZAMIDINEA1LR40.87
BENBENZAMIDINEA,B1V1M0.87
BENBENZAMIDINEA1ZHP0.87
BENBENZAMIDINEA2J9N0.87
BENBENZAMIDINEA2BMV0.87
BENBENZAMIDINEA,B2CKS0.87
BENBENZAMIDINEA2BLW0.87
BENBENZAMIDINEA1J160.87
BENBENZAMIDINEA,B1V110.87
BENBENZAMIDINEA,B,C,D,E,F3DP00.87
BENBENZAMIDINEB1RTF0.87
BENBENZAMIDINEA,B,C,D,E,F3DP10.87
BENBENZAMIDINEA,B,C,D2E580.87
BENBENZAMIDINEA2TRM0.87
BENBENZAMIDINET1V2V0.87
BENBENZAMIDINEA1MBQ0.87
BENBENZAMIDINEA,B,C,D,E,F3DOZ0.87
BENBENZAMIDINEA2O8U0.87
BENBENZAMIDINEH1DWB0.87
BENBENZAMIDINEB,C2ASS0.87
BENBENZAMIDINEA1ANE0.87
BENBENZAMIDINEH,I2ZIQ0.87
BENBENZAMIDINEA1BIT0.87
BENBENZAMIDINEA2AIQ0.87
BENBENZAMIDINEA2OQ50.87
BENBENZAMIDINEA1ANC0.87
BENBENZAMIDINEH1JBU0.87
BENBENZAMIDINEA,B2BPQ0.87
BENBENZAMIDINEA,B,C,D2GNN0.87
BENBENZAMIDINET1V2S0.87
BENBENZAMIDINEA1H4W0.87
BENBENZAMIDINEA1OSS0.87
BENBENZAMIDINEA1W800.87
BENBENZAMIDINEA1BTY0.87
BENBENZAMIDINEH,I2ZFQ0.87
BENBENZAMIDINEA1EAX0.87
BENBENZAMIDINEA1L2E0.87
BENBENZAMIDINEA1WRI0.87
BENBENZAMIDINEA,B3BB80.87
BENBENZAMIDINEA2OXS0.87
BENBENZAMIDINEA1DPO0.87
BENBENZAMIDINET1V2L0.87
PBZP-AMINO BENZAMIDINEA,B2BDG0.76
PBZP-AMINO BENZAMIDINEA1RFN0.76
PBZP-AMINO BENZAMIDINEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P
2BDI0.76
PBZP-AMINO BENZAMIDINEA,B,C,D2BDH0.76
PBZP-AMINO BENZAMIDINEA1FIZ0.76
PBZP-AMINO BENZAMIDINEA1FIW0.76
PBZP-AMINO BENZAMIDINEH,L,T2A2Q0.76
4CM(4-CARBAMIMIDOYLPHENYL)-METHYL-
PHOSPHINIC ACID
A1TX70.78
CGQ3-[C-[N'-(3-CARBAMIMIDOYL-BENZYLIDENIUM)-
HYDRAZINO]-[[AMINOMETHYLIDENE]AMINIUM]-
IMINOMETHYL]-BENZAMIDINIUM
A,B,D,E2G0E0.83
CGQ3-[C-[N'-(3-CARBAMIMIDOYL-BENZYLIDENIUM)-
HYDRAZINO]-[[AMINOMETHYLIDENE]AMINIUM]-
IMINOMETHYL]-BENZAMIDINIUM
A,B1M6F0.83
14WN-(3-(AMINOMETHYL)BENZYL)ACETAMIDINEA1QWC0.71
14WN-(3-(AMINOMETHYL)BENZYL)ACETAMIDINEA,B1FOI0.71
14WN-(3-(AMINOMETHYL)BENZYL)ACETAMIDINEA,B1QW50.71
AM44-(METHYLSULFONYL)BENZENECARBOXIMIDAMIDEA1TX80.72
BRNBERENILA,B268D0.84
BRNBERENILA,B1D630.84
BRNBERENILA,D,E2GBY0.84
BRNBERENILA2DBE0.84
BRNBERENILA2GVR0.84
ABNBENZYLAMINED,H2HXC0.72
ABNBENZYLAMINEA,I1A860.72
ABNBENZYLAMINEA1UTN0.72
ABNBENZYLAMINEA1N6X0.72
ABNBENZYLAMINEA2BZA0.72
ABNBENZYLAMINEA2EUS0.72
ABNBENZYLAMINEA1N6Y0.72
ABNBENZYLAMINEA1UTJ0.72