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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02333078

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
PRY2-PROPYL-ANILINEA1OWY0.7
2671-(azidomethyl)-3-methylbenzeneA2RBQ0.76
U195-IMINO-4-(2-TRIFLUOROMETHYL-PHENYLAZO)-
5H-PYRAZOL-3-YLAMINE
A2GG50.71
745TRANS-6-(2-PHENYLCYCLOPROPYL)-NAPHTHALENE-
2-CARBOXAMIDINE
A1U6Q0.74
FBA4-FLUOROBENZYLAMINEB,D,E1AFQ0.78
FBA4-FLUOROBENZYLAMINEA1TNH0.78
DBP1,3-DIAMINOBENZYL PHENYLALANINEA1A850.72
14WN-(3-(AMINOMETHYL)BENZYL)ACETAMIDINEA1QWC0.75
14WN-(3-(AMINOMETHYL)BENZYL)ACETAMIDINEA,B1FOI0.75
14WN-(3-(AMINOMETHYL)BENZYL)ACETAMIDINEA,B1QW50.75
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
B2FPHENYLALANINE BORONIC ACIDA,P1GBM0.72
B2FPHENYLALANINE BORONIC ACIDA,P1GBD0.72
B2FPHENYLALANINE BORONIC ACIDA,P1P060.72
B2FPHENYLALANINE BORONIC ACIDA,P1GBI0.72
B2FPHENYLALANINE BORONIC ACIDA,P8LPR0.72
BBA2,7-BIS-(4-AMIDINOBENZYLIDENE)-
CYCLOHEPTAN-1-ONE
A,B1A5H0.72
BBA2,7-BIS-(4-AMIDINOBENZYLIDENE)-
CYCLOHEPTAN-1-ONE
T1V2N0.72
L134-AMINO-5-(2-METHYLPHENYL)-2,4-
DIHYDRO-3H-1,2,4-TRIAZOLE-3-THIONE
A2HB90.74
ABNBENZYLAMINED,H2HXC0.82
ABNBENZYLAMINEA,I1A860.82
ABNBENZYLAMINEA1UTN0.82
ABNBENZYLAMINEA1N6X0.82
ABNBENZYLAMINEA2BZA0.82
ABNBENZYLAMINEA2EUS0.82
ABNBENZYLAMINEA1N6Y0.82
ABNBENZYLAMINEA1UTJ0.82
CGQ3-[C-[N'-(3-CARBAMIMIDOYL-BENZYLIDENIUM)-
HYDRAZINO]-[[AMINOMETHYLIDENE]AMINIUM]-
IMINOMETHYL]-BENZAMIDINIUM
A,B,D,E2G0E0.78
CGQ3-[C-[N'-(3-CARBAMIMIDOYL-BENZYLIDENIUM)-
HYDRAZINO]-[[AMINOMETHYLIDENE]AMINIUM]-
IMINOMETHYL]-BENZAMIDINIUM
A,B1M6F0.78
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
B2Y1-biphenyl-2-ylmethanamineA,B,C,D3CCB0.74
SBZ[4-(1,3,2-DIOXABOROLAN-2-YLOXY)METHYL]BENZAMIDINEA1S850.74
4BZ4-(HYDROXYMETHYL)BENZAMIDINEA1S6H0.73
MFG(1Z)-4-(4-FLUOROPHENYL)-2-METHYLIDENEBUTAN-
1-IMINE
A,B2VZ20.72
4CM(4-CARBAMIMIDOYLPHENYL)-METHYL-
PHOSPHINIC ACID
A1TX70.83
BENBENZAMIDINEA2TIO0.96
BENBENZAMIDINEA1J150.96
BENBENZAMIDINEA,B3BEU0.96
BENBENZAMIDINET1V2U0.96
BENBENZAMIDINEA,B,C,D,E,F3CF80.96
BENBENZAMIDINEA1S0R0.96
BENBENZAMIDINEA,B1V160.96
BENBENZAMIDINEA1CC70.96
BENBENZAMIDINEA3BG80.96
BENBENZAMIDINEA1CC80.96
BENBENZAMIDINEA3PTB0.96
BENBENZAMIDINEA,B1TRM0.96
BENBENZAMIDINEA1ZHR0.96
BENBENZAMIDINEA,B,C,D,E,F1NKZ0.96
BENBENZAMIDINEA2BLV0.96
BENBENZAMIDINEA,B,C,D,E,F2GLP0.96
BENBENZAMIDINEH,I3D490.96
BENBENZAMIDINEH,L,T2AER0.96
BENBENZAMIDINEA1J140.96
BENBENZAMIDINEA1NSA0.96
BENBENZAMIDINEA2AYW0.96
BENBENZAMIDINEA1BRA0.96
BENBENZAMIDINEA,B,C,D1A0J0.96
BENBENZAMIDINEB,C,D2AST0.96
BENBENZAMIDINEA,B2CKR0.96
BENBENZAMIDINEA1LPU0.96
BENBENZAMIDINEA1ZHM0.96
BENBENZAMIDINEA1J8A0.96
BENBENZAMIDINEA,B3BCX0.96
BENBENZAMIDINEA,B,C,D,E,F3CF90.96
BENBENZAMIDINEA,B,C,D,E,F3D040.96
BENBENZAMIDINEA,B,C,D,E,F2GLL0.96
BENBENZAMIDINEA1AND0.96
BENBENZAMIDINEA2TBS0.96
BENBENZAMIDINEA,B,C,D,E,F3DP20.96
BENBENZAMIDINET1V2M0.96
BENBENZAMIDINEA2EEK0.96
BENBENZAMIDINEH,I2ZI20.96
BENBENZAMIDINET1V2J0.96
BENBENZAMIDINEH1KLI0.96
BENBENZAMIDINEA1CE50.96
BENBENZAMIDINEA,B,C,D,E,F3B7J0.96
BENBENZAMIDINEB,Y2PKA0.96
BENBENZAMIDINEA2VJ00.96
BENBENZAMIDINEA3B3J0.96
BENBENZAMIDINEA,B,C,D,E,F3DOY0.96
BENBENZAMIDINEA,B,C,D,E,F3DP30.96
BENBENZAMIDINEA,B,C,D,E,F2GLM0.96
BENBENZAMIDINEA1ANB0.96
BENBENZAMIDINEA1LO60.96
BENBENZAMIDINEA1LR40.96
BENBENZAMIDINEA,B1V1M0.96
BENBENZAMIDINEA1ZHP0.96
BENBENZAMIDINEA2J9N0.96
BENBENZAMIDINEA2BMV0.96
BENBENZAMIDINEA,B2CKS0.96
BENBENZAMIDINEA2BLW0.96
BENBENZAMIDINEA1J160.96
BENBENZAMIDINEA,B1V110.96
BENBENZAMIDINEA,B,C,D,E,F3DP00.96
BENBENZAMIDINEB1RTF0.96
BENBENZAMIDINEA,B,C,D,E,F3DP10.96
BENBENZAMIDINEA,B,C,D2E580.96
BENBENZAMIDINEA2TRM0.96
BENBENZAMIDINET1V2V0.96
BENBENZAMIDINEA1MBQ0.96
BENBENZAMIDINEA,B,C,D,E,F3DOZ0.96
BENBENZAMIDINEA2O8U0.96
BENBENZAMIDINEH1DWB0.96
BENBENZAMIDINEB,C2ASS0.96
BENBENZAMIDINEA1ANE0.96
BENBENZAMIDINEH,I2ZIQ0.96
BENBENZAMIDINEA1BIT0.96
BENBENZAMIDINEA2AIQ0.96
BENBENZAMIDINEA2OQ50.96
BENBENZAMIDINEA1ANC0.96
BENBENZAMIDINEH1JBU0.96
BENBENZAMIDINEA,B2BPQ0.96
BENBENZAMIDINEA,B,C,D2GNN0.96
BENBENZAMIDINET1V2S0.96
BENBENZAMIDINEA1H4W0.96
BENBENZAMIDINEA1OSS0.96
BENBENZAMIDINEA1W800.96
BENBENZAMIDINEA1BTY0.96
BENBENZAMIDINEH,I2ZFQ0.96
BENBENZAMIDINEA1EAX0.96
BENBENZAMIDINEA1L2E0.96
BENBENZAMIDINEA1WRI0.96
BENBENZAMIDINEA,B3BB80.96
BENBENZAMIDINEA2OXS0.96
BENBENZAMIDINEA1DPO0.96
BENBENZAMIDINET1V2L0.96
AM44-(METHYLSULFONYL)BENZENECARBOXIMIDAMIDEA1TX80.76
U125-IMINO-4-(3-TRIFLUOROMETHYL-PHENYLAZO)-
5H-PYRAZOL-3-YLAMINE
A2GG20.71
BRNBERENILA,B268D0.77
BRNBERENILA,B1D630.77
BRNBERENILA,D,E2GBY0.77
BRNBERENILA2DBE0.77
BRNBERENILA2GVR0.77
BTMN-benzyl-N,N-diethylethanaminiumA,B2Q9Y0.71
271N-methyl-1-phenylmethanamineX2RBT0.75
C2A1-(3-CHLOROPHENYL)METHANAMINEB,I2C8Z0.72
PBZP-AMINO BENZAMIDINEA,B2BDG0.83
PBZP-AMINO BENZAMIDINEA1RFN0.83
PBZP-AMINO BENZAMIDINEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P
2BDI0.83
PBZP-AMINO BENZAMIDINEA,B,C,D2BDH0.83
PBZP-AMINO BENZAMIDINEA1FIZ0.83
PBZP-AMINO BENZAMIDINEA1FIW0.83
PBZP-AMINO BENZAMIDINEH,L,T2A2Q0.83
2631-(azidomethyl)-3-methylbenzeneX2RB20.76
TRJMETA-DI(AMINOMETHYL)BENZENEA,I1GVV0.8
TRJMETA-DI(AMINOMETHYL)BENZENEA1FQ50.8
BZZBENZYLHYDRAZINEA,B2E2V0.81
C2B1-(4-CHLOROPHENYL)METHANAMINED,H2Q7Q0.72
PRA3-PHENYLPROPYLAMINEA1TNK0.73
PRA3-PHENYLPROPYLAMINEM1UTL0.73
PBN4-PHENYLBUTYLAMINEA1TNI0.73
PBN4-PHENYLBUTYLAMINEA1UTP0.73
ESXBENZO[B]THIOPHENE-2-CARBOXAMIDINEA1C5S0.7
BAMBENZAMIDINEU1F5K0.96
BAMBENZAMIDINEX2BY80.96
BAMBENZAMIDINEB2PSM0.96
BAMBENZAMIDINEX2BY90.96
BAMBENZAMIDINEA1C1N0.96
BAMBENZAMIDINEX2BY60.96
BAMBENZAMIDINEH,I1C5O0.96
BAMBENZAMIDINEA1XX40.96
BAMBENZAMIDINEA1HJ80.96
BAMBENZAMIDINEA1C5P0.96
BAMBENZAMIDINEB1C5Z0.96
BAMBENZAMIDINEA,B1ZVW0.96
BAMBENZAMIDINEA2ANW0.96
BAMBENZAMIDINEA2ANY0.96
BAMBENZAMIDINEX2BYA0.96
BAMBENZAMIDINEA1TIO0.96
BAMBENZAMIDINEX2BY50.96
BAMBENZAMIDINEX2BY70.96
PO01-BENZYL-(R)-PROPYLAMINEA,I1LZQ0.72
PO01-BENZYL-(R)-PROPYLAMINEB,I1M0B0.72