BindingDB logo
myBDB logout

BDBM50095297 CHEMBL3589086

SMILES: CC(=N)NCc1cccc(CNC(=O)CC(O)=O)c1

InChI Key: InChIKey=KKUKTBVEYAJFEF-UHFFFAOYSA-N

Data: 1 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 1 hit for monomerid = 50095297   
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
Nitric Oxide Synthase, inducible


(Mus musculus (mouse))
BDBM50095297
PNG
(CHEMBL3589086)
Show SMILES CC(=N)NCc1cccc(CNC(=O)CC(O)=O)c1
Show InChI InChI=1S/C21H15Cl2N3O2/c1-27-14-7-8-15-16(9-14)21(28-13-5-3-2-4-6-13)26-25-20(15)10-17-18(22)11-24-12-19(17)23/h2-9,11-12H,10H2,1H3
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

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

Patents


Similars

Article
PubMed
n/an/a>1.00E+4n/an/an/an/an/an/a



University of Chieti"G. d'Annunzio"

Curated by ChEMBL


Assay Description
Inhibition of mouse recombinant iNOS using [3H]L-arginine substrate assessed as formation of [3H]L-citruline by liquid scintillation counting analysi...


ACS Med Chem Lett 6: 635-40 (2015)


Article DOI: 10.1021/acsmedchemlett.5b00149
BindingDB Entry DOI: 10.7270/Q2C53NKC
More data for this
Ligand-Target Pair