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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'G-protein coupled receptor 84' and Ligand = 'BDBM50245480'   
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
G-protein coupled receptor 84


(Homo sapiens (Human))		BDBM50245480
PNG
(CHEMBL4082477)
Show SMILES NC(=O)c1cccc(c1)-c1ccc-2c(CCn3c-2cc(OCC2COc4ncccc4O2)cc3=O)c1
Show InChI InChI=1S/C28H23N3O5/c29-27(33)20-4-1-3-17(12-20)18-6-7-23-19(11-18)8-10-31-24(23)13-21(14-26(31)32)34-15-22-16-35-28-25(36-22)5-2-9-30-28/h1-7,9,11-14,22H,8,10,15-16H2,(H2,29,33)
PDB

UniProtKB/SwissProt

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CHEMBL
PC cid
PC sid
UniChem

Similars
Article
PubMed
n/an/a 10n/an/an/an/an/an/a



Taipei Medical University

Curated by ChEMBL


Assay Description
Antagonist activity at GPR84 (unknown origin) expressed in cell membranes after 90 mins by [35S]GTPgammaS binding assay

J Med Chem 60: 527-553 (2017)


Article DOI: 10.1021/acs.jmedchem.6b00935
BindingDB Entry DOI: 10.7270/Q29C70V2
More data for this
Ligand-Target Pair