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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Integrase' and Ligand = 'BDBM50422698'   
Target/Host
(Institution)		LigandTarget/Host
Links		Ligand
Links		Trg + Lig
Links		Ki
nM		ΔG°
kJ/mole		IC50
nM		Kd
nM		EC50/IC50
nM		koff
s-1		kon
M-1s-1		pHTemp
°C
Integrase


(Human immunodeficiency virus 1)		BDBM50422698
PNG
(CHEMBL368424)
Show SMILES Cc1csc(c1)-c1cccc(Cn2c(=O)c3c(c2=O)c(=O)c2[nH]cc[nH]c2c3=O)c1
Show InChI InChI=1S/C22H15N3O4S/c1-11-7-14(30-10-11)13-4-2-3-12(8-13)9-25-21(28)15-16(22(25)29)20(27)18-17(19(15)26)23-5-6-24-18/h2-8,10,23-24H,9H2,1H3
PDB
MMDB

UniProtKB/TrEMBL

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 676n/an/an/an/an/an/a



Tibotec BVBA

Curated by ChEMBL


Assay Description
Log of inhibitory concentration against human immunodeficiency virus type 1 integrase

J Med Chem 48: 1930-40 (2005)


Article DOI: 10.1021/jm049559q
BindingDB Entry DOI: 10.7270/Q29Z94FZ
More data for this
Ligand-Target Pair