BindingDB logo
myBDB logout

BDBM50152199 CHEMBL183942::N-(3-Aminomethyl-phenyl)-2-(5-chloro-6-methyl-2-oxo-3-phenethylamino-2H-pyrazin-1-yl)-acetamide; TFA

SMILES: Cc1c(Cl)nc(NCCc2ccccc2)c(=O)n1CC(=O)Nc1cccc(CN)c1

InChI Key: InChIKey=BKJLSLLPQAKDES-UHFFFAOYSA-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 = 50152199   
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
Tryptase


(Homo sapiens (Human))
BDBM50152199
PNG
(CHEMBL183942 | N-(3-Aminomethyl-phenyl)-2-(5-chlor...)
Show SMILES Cc1c(Cl)nc(NCCc2ccccc2)c(=O)n1CC(=O)Nc1cccc(CN)c1
Show InChI InChI=1S/C22H24ClN5O2/c1-15-20(23)27-21(25-11-10-16-6-3-2-4-7-16)22(30)28(15)14-19(29)26-18-9-5-8-17(12-18)13-24/h2-9,12H,10-11,13-14,24H2,1H3,(H,25,27)(H,26,29)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
1.55E+3n/an/an/an/an/an/an/an/a



Aventis Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibitory activity against human Tryptase beta 2 expressed in yeast cells


Bioorg Med Chem Lett 14: 4819-23 (2004)


Article DOI: 10.1016/j.bmcl.2004.07.051
BindingDB Entry DOI: 10.7270/Q2H994NZ
More data for this
Ligand-Target Pair