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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03028620

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
7933-{[(1R)-1-phenylethyl]amino}-4-
(pyridin-4-ylamino)cyclobut-3-ene-
1,2-dione
A3FPM0.75
6IP6-[2-(1H-INDOL-6-YL)ETHYL]PYRIDIN-
2-AMINE
A2OHP0.71
AS34-METHYL-6-PROPYLPYRIDIN-2-AMINEA,B3E6N0.71
AUP2-(2-PHENYL-3-PYRIDIN-2-YL-4,5,6,7-
TETRAHYDRO-2H-ISOPHOSPHINDOL-1-
YL)PYRIDINE
A2AAQ0.72
11XN-(pyridin-3-ylmethyl)anilineA3EJ00.83
3MP3-METHYLPYRIDINEA1EUB0.78
3MP3-METHYLPYRIDINEA1BM60.78
3AP3-AMINOPYRIDINEA1AEF0.74
2755-amino-1,2-dimethylpyridiniumX2RBW0.75
2AP2-AMINOPYRIDINEA1AEO0.7
2862-ethenyl-1-methylpyridiniumX2RC20.76
2461-benzyl-3-(2-chloropyridin-4-yl)ureaA2QPM0.72
0471-CYCLOHEXYL-N-{[1-(4-METHYLPHENYL)-
1H-INDOL-3-YL]METHYL}METHANAMINE
A,B2PJL0.74
8APN~3~-BENZYLPYRIDINE-2,3-DIAMINEA2OHM0.76
5IQISOQUINOLIN-5-AMINEA,B2F2T0.78
1SQISOQUINOLIN-1-AMINEA2OHK0.73
1CM(2R)-2-PHENYL-N-PYRIDIN-4-YLBUTANAMIDEA2CI00.74
2781-(1-methyl-1H-pyrrol-2-yl)methanamineX2RBV0.74
4AP4-AMINOPYRIDINEA1AEG0.75
APY2-AMINOMETHYL-PYRIDINEA,B,I1HIV0.76
APY2-AMINOMETHYL-PYRIDINEI1IVP0.76
8IPN~3~-(3-PYRIDIN-3-YLBENZYL)PYRIDINE-
2,3-DIAMINE
A2OHR0.72