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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03471519

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
3MP3-METHYLPYRIDINEA1EUB0.75
3MP3-METHYLPYRIDINEA1BM60.75
2755-amino-1,2-dimethylpyridiniumX2RBW0.86
2AP2-AMINOPYRIDINEA1AEO0.75
8APN~3~-BENZYLPYRIDINE-2,3-DIAMINEA2OHM0.75
11XN-(pyridin-3-ylmethyl)anilineA3EJ00.81
4602-[5-(6-METHYLPYRIDIN-2-YL)-2,3-
DIHYDRO-1H-PYRAZOL-4-YL]-1,5-NAPHTHYRIDINE
A1VJY0.71
AUP2-(2-PHENYL-3-PYRIDIN-2-YL-4,5,6,7-
TETRAHYDRO-2H-ISOPHOSPHINDOL-1-
YL)PYRIDINE
A2AAQ0.75
2451-(2-chloropyridin-4-yl)-3-phenylureaA2QKN0.71
4AP4-AMINOPYRIDINEA1AEG0.8
0471-CYCLOHEXYL-N-{[1-(4-METHYLPHENYL)-
1H-INDOL-3-YL]METHYL}METHANAMINE
A,B2PJL0.76
2862-ethenyl-1-methylpyridiniumX2RC20.84
2MI2-METHYL-1H-INDOLEA2PIO0.71
3AP3-AMINOPYRIDINEA1AEF0.83
1PS3-PYRIDINIUM-1-YLPROPANE-1-SULFONATEA,B,C,D2RFQ0.74
1PS3-PYRIDINIUM-1-YLPROPANE-1-SULFONATEA,B,C,D,E,F2GA40.74
1PS3-PYRIDINIUM-1-YLPROPANE-1-SULFONATEA,B,C,D,E,F1R4P0.74
9DA9-DEAZAADENINEA1L1R0.76
9DA9-DEAZAADENINEA1L1Q0.76
5IQISOQUINOLIN-5-AMINEA,B2F2T0.74
AYM3-(6-AMINOPYRIDIN-3-YL)-N-METHYL-
N-[(1-METHYL-1H-INDOL-2-YL)METHYL]ACRYLAMIDE
A,B1LXC0.71
2781-(1-methyl-1H-pyrrol-2-yl)methanamineX2RBV0.91
APY2-AMINOMETHYL-PYRIDINEA,B,I1HIV0.87
APY2-AMINOMETHYL-PYRIDINEI1IVP0.87
6IP6-[2-(1H-INDOL-6-YL)ETHYL]PYRIDIN-
2-AMINE
A2OHP0.74