BindingDB logo
myBDB logout

null

SMILES: Oc1nn(CCc2cccc3ccccc23)c(=O)[nH]c1=O

InChI Key: InChIKey=YKGMBYXABVNRBZ-UHFFFAOYSA-N

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 = 50117809   
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
D-amino-acid oxidase


(Homo sapiens (Human))
BDBM50117809
PNG
(CHEMBL3613922 | US9505753, 5n)
Show SMILES Oc1nn(CCc2cccc3ccccc23)c(=O)[nH]c1=O
Show InChI InChI=1S/C15H13N3O3/c19-13-14(20)17-18(15(21)16-13)9-8-11-6-3-5-10-4-1-2-7-12(10)11/h1-7H,8-9H2,(H,17,20)(H,16,19,21)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

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

Similars

PubMed
n/an/a 100n/an/an/an/an/an/a



Johns Hopkins University

Curated by ChEMBL


Assay Description
Inhibition of recombinant human DAAO expressed in HEK cells using D-serine as substrate assessed as formation of alpha-keto acid, ammonia, hydrogen p...


J Med Chem 58: 7258-72 (2015)


BindingDB Entry DOI: 10.7270/Q2SF2XZQ
More data for this
Ligand-Target Pair
D-amino-acid oxidase


(Homo sapiens (Human))
BDBM50117809
PNG
(CHEMBL3613922 | US9505753, 5n)
Show SMILES Oc1nn(CCc2cccc3ccccc23)c(=O)[nH]c1=O
Show InChI InChI=1S/C15H13N3O3/c19-13-14(20)17-18(15(21)16-13)9-8-11-6-3-5-10-4-1-2-7-12(10)11/h1-7H,8-9H2,(H,17,20)(H,16,19,21)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

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

Similars

US Patent
n/an/a 100n/an/an/an/a8.525



THE JOHNS HOPKINS UNIVERSITY

US Patent


Assay Description
A reliable 96-well plate D-amino acid oxidase (DAAO) assay was developed based on previously published reports (J. Biol. Chem. 277: 27782 (2002)). Br...


US Patent US9505753 (2016)


BindingDB Entry DOI: 10.7270/Q21J98QK
More data for this
Ligand-Target Pair