BDBM50366315 CHEMBL1163096::CHEMBL3392218

SMILES: NC(CCCSC[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)ncnc12)C#N

InChI Key: InChIKey=PCTICNZTQMFWRB-ATJVVDHWSA-N

Data: 1 IC50

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50366315   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
S-adenosylmethionine decarboxylase 1 (Homo sapiens (Human))	BDBM50366315 (CHEMBL1163096 | CHEMBL3392218) Show SMILES NC(CCCSC[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)ncnc12)C#N |r| Show InChI InChI=1S/C15H21N7O3S/c16-4-8(17)2-1-3-26-5-9-11(23)12(24)15(25-9)22-7-21-10-13(18)19-6-20-14(10)22/h6-9,11-12,15,23-24H,1-3,5,17H2,(H2,18,19,20)/t8?,9-,11-,12-,15?/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	2.05E+5	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Compound was evaluated for its inhibitory activity against AdoMet-DC from Escherichia coli				Bioorg Med Chem Lett 3: 2811-2816 (1993) Article DOI: 10.1016/S0960-894X(01)80770-8 BindingDB Entry DOI: 10.7270/Q2TH8N6T
					More data for this Ligand-Target Pair