BDBM50234704 CHEMBL4096018

SMILES: COc1ccc(Cn2c(-c3ccc(C)cc3)c(-c3cc(C)cc(C)c3)c(=O)c3cc(ccc23)[N+]([O-])=O)cc1

InChI Key: InChIKey=GJKGNJQRZAAJGA-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 = 50234704   

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
Intestinal alkaline phosphatase (Bos taurus (Cattle))	BDBM50234704 (CHEMBL4096018) Show SMILES COc1ccc(Cn2c(-c3ccc(C)cc3)c(-c3cc(C)cc(C)c3)c(=O)c3cc(ccc23)[N+]([O-])=O)cc1 Show InChI InChI=1S/C32H28N2O4/c1-20-5-9-24(10-6-20)31-30(25-16-21(2)15-22(3)17-25)32(35)28-18-26(34(36)37)11-14-29(28)33(31)19-23-7-12-27(38-4)13-8-23/h5-18H,19H2,1-4H3	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	2.87E+4	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
Tissue non-specific alkaline phosphatase (TNAP) (Bos taurus (Cattle))	BDBM50234704 (CHEMBL4096018) Show SMILES COc1ccc(Cn2c(-c3ccc(C)cc3)c(-c3cc(C)cc(C)c3)c(=O)c3cc(ccc23)[N+]([O-])=O)cc1 Show InChI InChI=1S/C32H28N2O4/c1-20-5-9-24(10-6-20)31-30(25-16-21(2)15-22(3)17-25)32(35)28-18-26(34(36)37)11-14-29(28)33(31)19-23-7-12-27(38-4)13-8-23/h5-18H,19H2,1-4H3	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	4.74E+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