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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02028376

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
3MP3-METHYLPYRIDINEA1EUB0.73
3MP3-METHYLPYRIDINEA1BM60.73
APY2-AMINOMETHYL-PYRIDINEA,B,I1HIV0.74
APY2-AMINOMETHYL-PYRIDINEI1IVP0.74
GVH1H-PYRROLO[2,3-B]PYRIDINEA2UVX0.71
2AP2-AMINOPYRIDINEA1AEO0.84
2755-amino-1,2-dimethylpyridiniumX2RBW0.72
BVF4-METHYLPYRIDIN-2-AMINEA,B3E670.83
BVF4-METHYLPYRIDIN-2-AMINEA2EUT0.83
CBQ[(5-CHLORO-PYRIDIN-2-YLAMINO)-PHOSPHONO-
METHYL]-PHOSPHONIC ACID
A,B1T1S0.75
8APN~3~-BENZYLPYRIDINE-2,3-DIAMINEA2OHM0.75
1MSN-[(4-methylpyrimidin-2-yl)carbamoyl]-
2-nitrobenzenesulfonamide
A3E9Y0.71
D4GA,B,C,D2FDY0.77
1BY[2-(PYRIDIN-2-YLAMINO)ETHANE-1,1-
DIYL]BIS(PHOSPHONIC ACID)
A,B2I190.79
1PS3-PYRIDINIUM-1-YLPROPANE-1-SULFONATEA,B,C,D2RFQ0.8
1PS3-PYRIDINIUM-1-YLPROPANE-1-SULFONATEA,B,C,D,E,F2GA40.8
1PS3-PYRIDINIUM-1-YLPROPANE-1-SULFONATEA,B,C,D,E,F1R4P0.8
2862-ethenyl-1-methylpyridiniumX2RC20.71
3AP3-AMINOPYRIDINEA1AEF0.73
HDT4-[(4-IMIDAZO[1,2-A]PYRIDIN-3-YLPYRIMIDIN-
2-YL)AMINO]BENZENESULFONAMIDE
A1OIT0.7
26DPYRIDINE-2,6-DIAMINEA2ANZ0.8
1SQISOQUINOLIN-1-AMINEA2OHK0.75
DA1PYRIDINE-2,5-DIAMINEA2AQD0.83
11XN-(pyridin-3-ylmethyl)anilineA3EJ00.7
4AP4-AMINOPYRIDINEA1AEG0.73