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BDBM85031 CAS_604-75-1::NSC_4616::Oxazepam

SMILES: OC1N=C(c2ccccc2)c2cc(Cl)ccc2NC1=O

InChI Key: InChIKey=ADIMAYPTOBDMTL-UHFFFAOYSA-N

Data: 1 KI  1 IC50  1 Kd

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 85031   
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
Gamma-aminobutyric acid receptor subunit alpha-1 (GABA(A) alpha-1)


(Rattus norvegicus (Rat))
BDBM85031
PNG
(CAS_604-75-1 | NSC_4616 | Oxazepam)
Show SMILES OC1N=C(c2ccccc2)c2cc(Cl)ccc2NC1=O
Show InChI InChI=1S/C15H11ClN2O2/c16-10-6-7-12-11(8-10)13(9-4-2-1-3-5-9)18-15(20)14(19)17-12/h1-8,15,20H,(H,17,19)
PDB

UniProtKB/SwissProt

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KEGG
PC cid
PC sid
UniChem

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PubMed
350n/an/an/an/an/an/an/an/a



Leiden University

Curated by PDSP Ki Database




J Pharmacol Exp Ther 279: 803-12 (1996)

More data for this
Ligand-Target Pair
Translocator protein


(Homo sapiens (Human))
BDBM85031
PNG
(CAS_604-75-1 | NSC_4616 | Oxazepam)
Show SMILES OC1N=C(c2ccccc2)c2cc(Cl)ccc2NC1=O
Show InChI InChI=1S/C15H11ClN2O2/c16-10-6-7-12-11(8-10)13(9-4-2-1-3-5-9)18-15(20)14(19)17-12/h1-8,15,20H,(H,17,19)
KEGG

UniProtKB/SwissProt

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KEGG
PC cid
PC sid
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Article
PubMed
n/an/a 1.80E+10n/an/an/an/an/an/a



Harvard University

Curated by ChEMBL


Assay Description
Binding affinity of compound towards Benzodiazepine receptor in a competition assay


J Med Chem 39: 5246-56 (1997)

More data for this
Ligand-Target Pair
Serum albumin


(Homo sapiens)
BDBM85031
PNG
(CAS_604-75-1 | NSC_4616 | Oxazepam)
Show SMILES OC1N=C(c2ccccc2)c2cc(Cl)ccc2NC1=O
Show InChI InChI=1S/C15H11ClN2O2/c16-10-6-7-12-11(8-10)13(9-4-2-1-3-5-9)18-15(20)14(19)17-12/h1-8,15,20H,(H,17,19)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

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

Patents


Similars

Article
PubMed
n/an/an/a 6.92E+4n/an/an/an/an/a



Universitat de Barcelona

Curated by ChEMBL


Assay Description
Binding affinity to human serum albumin by PAMPA method


J Med Chem 51: 2009-17 (2008)

More data for this
Ligand-Target Pair