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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02229011

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
FBA4-FLUOROBENZYLAMINEB,D,E1AFQ0.7
FBA4-FLUOROBENZYLAMINEA1TNH0.7
BAMBENZAMIDINEU1F5K0.88
BAMBENZAMIDINEX2BY80.88
BAMBENZAMIDINEB2PSM0.88
BAMBENZAMIDINEX2BY90.88
BAMBENZAMIDINEA1C1N0.88
BAMBENZAMIDINEX2BY60.88
BAMBENZAMIDINEH,I1C5O0.88
BAMBENZAMIDINEA1XX40.88
BAMBENZAMIDINEA1HJ80.88
BAMBENZAMIDINEA1C5P0.88
BAMBENZAMIDINEB1C5Z0.88
BAMBENZAMIDINEA,B1ZVW0.88
BAMBENZAMIDINEA2ANW0.88
BAMBENZAMIDINEA2ANY0.88
BAMBENZAMIDINEX2BYA0.88
BAMBENZAMIDINEA1TIO0.88
BAMBENZAMIDINEX2BY50.88
BAMBENZAMIDINEX2BY70.88
SBZ[4-(1,3,2-DIOXABOROLAN-2-YLOXY)METHYL]BENZAMIDINEA1S850.73
PBZP-AMINO BENZAMIDINEA,B2BDG0.77
PBZP-AMINO BENZAMIDINEA1RFN0.77
PBZP-AMINO BENZAMIDINEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P
2BDI0.77
PBZP-AMINO BENZAMIDINEA,B,C,D2BDH0.77
PBZP-AMINO BENZAMIDINEA1FIZ0.77
PBZP-AMINO BENZAMIDINEA1FIW0.77
PBZP-AMINO BENZAMIDINEH,L,T2A2Q0.77
4BZ4-(HYDROXYMETHYL)BENZAMIDINEA1S6H0.72
IN4+/-METHYL 4-(AMINOIMINOMETHYL)-
BETA-[3- INH (AMINOIMINO)PHENYL]BENZENE PENTANOATE
A1AZ80.72
B2Y1-biphenyl-2-ylmethanamineA,B,C,D3CCB0.74
2631-(azidomethyl)-3-methylbenzeneX2RB20.7
TRJMETA-DI(AMINOMETHYL)BENZENEA,I1GVV0.74
TRJMETA-DI(AMINOMETHYL)BENZENEA1FQ50.74
2671-(azidomethyl)-3-methylbenzeneA2RBQ0.7
ABNBENZYLAMINED,H2HXC0.73
ABNBENZYLAMINEA,I1A860.73
ABNBENZYLAMINEA1UTN0.73
ABNBENZYLAMINEA1N6X0.73
ABNBENZYLAMINEA2BZA0.73
ABNBENZYLAMINEA2EUS0.73
ABNBENZYLAMINEA1N6Y0.73
ABNBENZYLAMINEA1UTJ0.73
BENBENZAMIDINEA2TIO0.88
BENBENZAMIDINEA1J150.88
BENBENZAMIDINEA,B3BEU0.88
BENBENZAMIDINET1V2U0.88
BENBENZAMIDINEA,B,C,D,E,F3CF80.88
BENBENZAMIDINEA1S0R0.88
BENBENZAMIDINEA,B1V160.88
BENBENZAMIDINEA1CC70.88
BENBENZAMIDINEA3BG80.88
BENBENZAMIDINEA1CC80.88
BENBENZAMIDINEA3PTB0.88
BENBENZAMIDINEA,B1TRM0.88
BENBENZAMIDINEA1ZHR0.88
BENBENZAMIDINEA,B,C,D,E,F1NKZ0.88
BENBENZAMIDINEA2BLV0.88
BENBENZAMIDINEA,B,C,D,E,F2GLP0.88
BENBENZAMIDINEH,I3D490.88
BENBENZAMIDINEH,L,T2AER0.88
BENBENZAMIDINEA1J140.88
BENBENZAMIDINEA1NSA0.88
BENBENZAMIDINEA2AYW0.88
BENBENZAMIDINEA1BRA0.88
BENBENZAMIDINEA,B,C,D1A0J0.88
BENBENZAMIDINEB,C,D2AST0.88
BENBENZAMIDINEA,B2CKR0.88
BENBENZAMIDINEA1LPU0.88
BENBENZAMIDINEA1ZHM0.88
BENBENZAMIDINEA1J8A0.88
BENBENZAMIDINEA,B3BCX0.88
BENBENZAMIDINEA,B,C,D,E,F3CF90.88
BENBENZAMIDINEA,B,C,D,E,F3D040.88
BENBENZAMIDINEA,B,C,D,E,F2GLL0.88
BENBENZAMIDINEA1AND0.88
BENBENZAMIDINEA2TBS0.88
BENBENZAMIDINEA,B,C,D,E,F3DP20.88
BENBENZAMIDINET1V2M0.88
BENBENZAMIDINEA2EEK0.88
BENBENZAMIDINEH,I2ZI20.88
BENBENZAMIDINET1V2J0.88
BENBENZAMIDINEH1KLI0.88
BENBENZAMIDINEA1CE50.88
BENBENZAMIDINEA,B,C,D,E,F3B7J0.88
BENBENZAMIDINEB,Y2PKA0.88
BENBENZAMIDINEA2VJ00.88
BENBENZAMIDINEA3B3J0.88
BENBENZAMIDINEA,B,C,D,E,F3DOY0.88
BENBENZAMIDINEA,B,C,D,E,F3DP30.88
BENBENZAMIDINEA,B,C,D,E,F2GLM0.88
BENBENZAMIDINEA1ANB0.88
BENBENZAMIDINEA1LO60.88
BENBENZAMIDINEA1LR40.88
BENBENZAMIDINEA,B1V1M0.88
BENBENZAMIDINEA1ZHP0.88
BENBENZAMIDINEA2J9N0.88
BENBENZAMIDINEA2BMV0.88
BENBENZAMIDINEA,B2CKS0.88
BENBENZAMIDINEA2BLW0.88
BENBENZAMIDINEA1J160.88
BENBENZAMIDINEA,B1V110.88
BENBENZAMIDINEA,B,C,D,E,F3DP00.88
BENBENZAMIDINEB1RTF0.88
BENBENZAMIDINEA,B,C,D,E,F3DP10.88
BENBENZAMIDINEA,B,C,D2E580.88
BENBENZAMIDINEA2TRM0.88
BENBENZAMIDINET1V2V0.88
BENBENZAMIDINEA1MBQ0.88
BENBENZAMIDINEA,B,C,D,E,F3DOZ0.88
BENBENZAMIDINEA2O8U0.88
BENBENZAMIDINEH1DWB0.88
BENBENZAMIDINEB,C2ASS0.88
BENBENZAMIDINEA1ANE0.88
BENBENZAMIDINEH,I2ZIQ0.88
BENBENZAMIDINEA1BIT0.88
BENBENZAMIDINEA2AIQ0.88
BENBENZAMIDINEA2OQ50.88
BENBENZAMIDINEA1ANC0.88
BENBENZAMIDINEH1JBU0.88
BENBENZAMIDINEA,B2BPQ0.88
BENBENZAMIDINEA,B,C,D2GNN0.88
BENBENZAMIDINET1V2S0.88
BENBENZAMIDINEA1H4W0.88
BENBENZAMIDINEA1OSS0.88
BENBENZAMIDINEA1W800.88
BENBENZAMIDINEA1BTY0.88
BENBENZAMIDINEH,I2ZFQ0.88
BENBENZAMIDINEA1EAX0.88
BENBENZAMIDINEA1L2E0.88
BENBENZAMIDINEA1WRI0.88
BENBENZAMIDINEA,B3BB80.88
BENBENZAMIDINEA2OXS0.88
BENBENZAMIDINEA1DPO0.88
BENBENZAMIDINET1V2L0.88
BRNBERENILA,B268D0.77
BRNBERENILA,B1D630.77
BRNBERENILA,D,E2GBY0.77
BRNBERENILA2DBE0.77
BRNBERENILA2GVR0.77
745TRANS-6-(2-PHENYLCYCLOPROPYL)-NAPHTHALENE-
2-CARBOXAMIDINE
A1U6Q0.8
4CM(4-CARBAMIMIDOYLPHENYL)-METHYL-
PHOSPHINIC ACID
A1TX70.78
14WN-(3-(AMINOMETHYL)BENZYL)ACETAMIDINEA1QWC0.71
14WN-(3-(AMINOMETHYL)BENZYL)ACETAMIDINEA,B1FOI0.71
14WN-(3-(AMINOMETHYL)BENZYL)ACETAMIDINEA,B1QW50.71
AM44-(METHYLSULFONYL)BENZENECARBOXIMIDAMIDEA1TX80.72
BBA2,7-BIS-(4-AMIDINOBENZYLIDENE)-
CYCLOHEPTAN-1-ONE
A,B1A5H0.8
BBA2,7-BIS-(4-AMIDINOBENZYLIDENE)-
CYCLOHEPTAN-1-ONE
T1V2N0.8
CGQ3-[C-[N'-(3-CARBAMIMIDOYL-BENZYLIDENIUM)-
HYDRAZINO]-[[AMINOMETHYLIDENE]AMINIUM]-
IMINOMETHYL]-BENZAMIDINIUM
A,B,D,E2G0E0.8
CGQ3-[C-[N'-(3-CARBAMIMIDOYL-BENZYLIDENIUM)-
HYDRAZINO]-[[AMINOMETHYLIDENE]AMINIUM]-
IMINOMETHYL]-BENZAMIDINIUM
A,B1M6F0.8