BindingDB logo
myBDB logout

BDBM50349362 CHEMBL1809217

SMILES: NC(=N)c1ccc(CNC(=O)[C@@H]2CCCN2C(=O)[C@@H](CCCCNC(=O)OCc2ccccc2)NS(=O)(=O)Cc2ccccc2)cc1

InChI Key: InChIKey=HDHQCDZBZNXVEN-IHLOFXLRSA-N

Data: 1 KI

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 = 50349362   
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
Transmembrane protease serine 11D


(Homo sapiens (Human))		BDBM50349362
PNG
(CHEMBL1809217)
Show SMILES NC(=N)c1ccc(CNC(=O)[C@@H]2CCCN2C(=O)[C@@H](CCCCNC(=O)OCc2ccccc2)NS(=O)(=O)Cc2ccccc2)cc1 |r|
Show InChI InChI=1S/C34H42N6O6S/c35-31(36)28-18-16-25(17-19-28)22-38-32(41)30-15-9-21-40(30)33(42)29(39-47(44,45)24-27-12-5-2-6-13-27)14-7-8-20-37-34(43)46-23-26-10-3-1-4-11-26/h1-6,10-13,16-19,29-30,39H,7-9,14-15,20-24H2,(H3,35,36)(H,37,43)(H,38,41)/t29-,30+/m1/s1
KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars
Article
PubMed
 53n/an/an/an/an/an/an/an/a



Philipps University Marburg

Curated by ChEMBL


Assay Description
Inhibition of human recombinant airway trypsin-like protease HAT using D-cyclohexylalanine-Pro-Arg-AMC as substrate by fluorescence plate reader anal...

Bioorg Med Chem Lett 21: 4860-4 (2011)


Article DOI: 10.1016/j.bmcl.2011.06.033
BindingDB Entry DOI: 10.7270/Q2ST7Q5M
More data for this
Ligand-Target Pair