BDBM50028310 CHEMBL3342258

SMILES: Cc1ccc(cc1)C(CCC(=O)NO)P(O)(O)=O

InChI Key: InChIKey=SCBADMOVHOXNEN-UHFFFAOYSA-N

Data: 2 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 2 hits for monomerid = 50028310   

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
1-deoxy-D-xylulose 5-phosphate reductoisomerase (Mycobacterium tuberculosis)	BDBM50028310 (CHEMBL3342258) Show SMILES Cc1ccc(cc1)C(CCC(=O)NO)P(O)(O)=O Show InChI InChI=1S/C11H16NO5P/c1-8-2-4-9(5-3-8)10(18(15,16)17)6-7-11(13)12-14/h2-5,10,14H,6-7H2,1H3,(H,12,13)(H2,15,16,17)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.10E+4	n/a	n/a	n/a	n/a	n/a	n/a
Heinrich Heine Universit£t Curated by ChEMBL					Assay Description Inhibition of Mycobacterium tuberculosis IspC using 1-deoxy-D-xylulose 5-phosphate as substrate by photometric analysis				J Med Chem 57: 8827-38 (2014) Article DOI: 10.1021/jm500850y BindingDB Entry DOI: 10.7270/Q2KP83RX
					More data for this Ligand-Target Pair
1-deoxy-D-xylulose 5-phosphate reductoisomerase (Escherichia coli)	BDBM50028310 (CHEMBL3342258) Show SMILES Cc1ccc(cc1)C(CCC(=O)NO)P(O)(O)=O Show InChI InChI=1S/C11H16NO5P/c1-8-2-4-9(5-3-8)10(18(15,16)17)6-7-11(13)12-14/h2-5,10,14H,6-7H2,1H3,(H,12,13)(H2,15,16,17)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	700	n/a	n/a	n/a	n/a	n/a	n/a
Heinrich Heine Universit£t Curated by ChEMBL					Assay Description Inhibition of Escherichia coli M15 recombinant IspC using 1-deoxy-D-xylulose 5-phosphate as substrate by photometric analysis				J Med Chem 57: 8827-38 (2014) Article DOI: 10.1021/jm500850y BindingDB Entry DOI: 10.7270/Q2KP83RX
					More data for this Ligand-Target Pair