BDBM50234719 CHEMBL4062180

SMILES: CCCCCc1cc(=O)c2cc(ccc2n1Cc1ccc(OC)cc1)[N+]([O-])=O

InChI Key: InChIKey=BLBDCKLPWFKOSV-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 = 50234719   

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
Tissue non-specific alkaline phosphatase (TNAP) (Bos taurus (Cattle))	BDBM50234719 (CHEMBL4062180) Show SMILES CCCCCc1cc(=O)c2cc(ccc2n1Cc1ccc(OC)cc1)[N+]([O-])=O Show InChI InChI=1S/C22H24N2O4/c1-3-4-5-6-17-14-22(25)20-13-18(24(26)27)9-12-21(20)23(17)15-16-7-10-19(28-2)11-8-16/h7-14H,3-6,15H2,1-2H3	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL MMDB PC cid PC sid UniChem Similars	PubMed	n/a	n/a	1.51E+3	n/a	n/a	n/a	n/a	n/a	n/a
Universit£t Rostock Curated by ChEMBL					Assay Description Inhibition of bovine TNAP using CDP-star as substrate preincubated for 5 to 7 mins followed by substrate addition measured after 15 mins by spectroph...				Eur J Med Chem 126: 408-420 (2017) BindingDB Entry DOI: 10.7270/Q2DZ0BKR
					More data for this Ligand-Target Pair
Intestinal alkaline phosphatase (Bos taurus (Cattle))	BDBM50234719 (CHEMBL4062180) Show SMILES CCCCCc1cc(=O)c2cc(ccc2n1Cc1ccc(OC)cc1)[N+]([O-])=O Show InChI InChI=1S/C22H24N2O4/c1-3-4-5-6-17-14-22(25)20-13-18(24(26)27)9-12-21(20)23(17)15-16-7-10-19(28-2)11-8-16/h7-14H,3-6,15H2,1-2H3	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL MMDB PC cid PC sid UniChem Similars	PubMed	n/a	n/a	1.38E+3	n/a	n/a	n/a	n/a	n/a	n/a
Universit£t Rostock Curated by ChEMBL					Assay Description Inhibition of calf intestinal alkaline phosphatase using CDP-star as substrate preincubated for 5 to 7 mins followed by substrate addition measured a...				Eur J Med Chem 126: 408-420 (2017) BindingDB Entry DOI: 10.7270/Q2DZ0BKR
					More data for this Ligand-Target Pair