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SMILES: CCCCCc1cc(=O)c2cc(ccc2[nH]1)[N+]([O-])=O

InChI Key: InChIKey=OHCWJLHWVKQMKI-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50234722   
Target/Host
(Institution)		LigandTarget/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		pHTemp
°C
Alkaline phosphatase, tissue-nonspecific isozyme


(Bos taurus (Cattle))		BDBM50234722
PNG
(CHEMBL4063224)
Show SMILES CCCCCc1cc(=O)c2cc(ccc2[nH]1)[N+]([O-])=O
Show InChI InChI=1S/C14H16N2O3/c1-2-3-4-5-10-8-14(17)12-9-11(16(18)19)6-7-13(12)15-10/h6-9H,2-5H2,1H3,(H,15,17)
UniProtKB/SwissProt

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CHEMBL
PC cid
PC sid
UniChem

Patents
PubMed
n/an/a 4.48E+4n/an/an/an/an/an/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-type alkaline phosphatase


(Bos taurus (Cattle))		BDBM50234722
PNG
(CHEMBL4063224)
Show SMILES CCCCCc1cc(=O)c2cc(ccc2[nH]1)[N+]([O-])=O
Show InChI InChI=1S/C14H16N2O3/c1-2-3-4-5-10-8-14(17)12-9-11(16(18)19)6-7-13(12)15-10/h6-9H,2-5H2,1H3,(H,15,17)
UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents
PubMed
n/an/a 1.67E+4n/an/an/an/an/an/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