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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs01089945

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
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
GP61-(4-AMIDINOPHENYL)-3-(4-CHLOROPHENYL)UREAA1BJU0.72
1AN2-FLUOROANILINEA1LGW0.7
TFMS-ETHYL-N-[4-(TRIFLUOROMETHYL)PHENYL]ISOTHIOUREAA,B1K2U0.72
PBZP-AMINO BENZAMIDINEA,B2BDG0.92
PBZP-AMINO BENZAMIDINEA1RFN0.92
PBZP-AMINO BENZAMIDINEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P
2BDI0.92
PBZP-AMINO BENZAMIDINEA,B,C,D2BDH0.92
PBZP-AMINO BENZAMIDINEA1FIZ0.92
PBZP-AMINO BENZAMIDINEA1FIW0.92
PBZP-AMINO BENZAMIDINEH,L,T2A2Q0.92
5AN3,5-DIFLUOROANILINEA1LGX0.7
ASR4-AMINOPHENYLARSONIC ACIDA1N4F0.71
ANCANTHRACEN-1-YLAMINEA,B1GT10.74
ANCANTHRACEN-1-YLAMINEA,B1HN20.74
9AP9-AMINOPHENANTHRENEA1EGY0.73
U125-IMINO-4-(3-TRIFLUOROMETHYL-PHENYLAZO)-
5H-PYRAZOL-3-YLAMINE
A2GG20.84
U195-IMINO-4-(2-TRIFLUOROMETHYL-PHENYLAZO)-
5H-PYRAZOL-3-YLAMINE
A2GG50.82
ANLANILINEA2OV40.73
ANLANILINEA1AEE0.73
ANLANILINEA1PPA0.73
ANLANILINEA1HJ90.73
TRJMETA-DI(AMINOMETHYL)BENZENEA,I1GVV0.71
TRJMETA-DI(AMINOMETHYL)BENZENEA1FQ50.71
ISOPARA-ISOPROPYLANILINEA1BMA0.8
ISOPARA-ISOPROPYLANILINEA,B1ELC0.8
ISOPARA-ISOPROPYLANILINEA,B1ELB0.8
ISOPARA-ISOPROPYLANILINEA,B1ELA0.8
U134-(4-FLUORO-PHENYLAZO)-5-IMINO-
5H-PYRAZOL-3-YLAMINE
A2GG30.76
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
APBM-AMINOPHENYLBORONIC ACIDA,B3BLS0.71
CGQ3-[C-[N'-(3-CARBAMIMIDOYL-BENZYLIDENIUM)-
HYDRAZINO]-[[AMINOMETHYLIDENE]AMINIUM]-
IMINOMETHYL]-BENZAMIDINIUM
A,B,D,E2G0E0.71
CGQ3-[C-[N'-(3-CARBAMIMIDOYL-BENZYLIDENIUM)-
HYDRAZINO]-[[AMINOMETHYLIDENE]AMINIUM]-
IMINOMETHYL]-BENZAMIDINIUM
A,B1M6F0.71
BRNBERENILA,B268D0.86
BRNBERENILA,B1D630.86
BRNBERENILA,D,E2GBY0.86
BRNBERENILA2DBE0.86
BRNBERENILA2GVR0.86
DBP1,3-DIAMINOBENZYL PHENYLALANINEA1A850.81
PNZP-NITRO-BENZYLAMINEA,D,H2HJ40.71
PNZP-NITRO-BENZYLAMINEA,B2C700.71
34A3,4-DIMETHYLANILINEA1L4K0.8
XYD2,5-DIMETHYLANILINEA,B,C,D1KYA0.81
XYD2,5-DIMETHYLANILINEA1L4L0.81
TPM2-(4-AMINOBENZYLAMINO)-3,4,5,6-
TETRAHYDROPYRIDINIUM
J,K,L1F3D0.76
14WN-(3-(AMINOMETHYL)BENZYL)ACETAMIDINEA1QWC0.71
14WN-(3-(AMINOMETHYL)BENZYL)ACETAMIDINEA,B1FOI0.71
14WN-(3-(AMINOMETHYL)BENZYL)ACETAMIDINEA,B1QW50.71
PRY2-PROPYL-ANILINEA1OWY0.8
ANI4-TRIFLUOROMETHYLANILINEE,I1ELE0.76
ANI4-TRIFLUOROMETHYLANILINEE,I7EST0.76
ANI4-TRIFLUOROMETHYLANILINEE,I2EST0.76
ANI4-TRIFLUOROMETHYLANILINEE,I1ELD0.76
FLM3-FLUORO-2-METHYL-ANILINEA1OVJ0.77
1504,5-DIMETHYL-1,2-PHENYLENEDIAMINEA1L4F0.79
4CM(4-CARBAMIMIDOYLPHENYL)-METHYL-
PHOSPHINIC ACID
A1TX70.73
PL01-phenylguanidineA2O8W0.7
UA5(4-ETHYLPHENYL)SULFAMIC ACIDA,B2I5X0.74