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SMILES: Cc1cccc(C)c1NC(=O)C(Cc1c[nH]c2ccccc12)NC(=O)CCc1ccccc1

InChI Key: InChIKey=GZHWXKWTIPLMGA-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50525153   
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
Tumor necrosis factor ligand superfamily member 11


(Homo sapiens)		BDBM50525153
PNG
(CHEMBL4560856)
Show SMILES Cc1cccc(C)c1NC(=O)C(Cc1c[nH]c2ccccc12)NC(=O)CCc1ccccc1
Show InChI InChI=1S/C28H29N3O2/c1-19-9-8-10-20(2)27(19)31-28(33)25(17-22-18-29-24-14-7-6-13-23(22)24)30-26(32)16-15-21-11-4-3-5-12-21/h3-14,18,25,29H,15-17H2,1-2H3,(H,30,32)(H,31,33)
PDB

UniProtKB/SwissProt

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PC cid
PC sid
UniChem
Article
PubMed
n/an/an/a 2.70E+3n/an/an/an/an/a



Shanghai Jiaotong University School of Medicine

Curated by ChEMBL


Assay Description
Binding affinity to human RANKL by surface plasmon resonance analysis

J Med Chem 62: 5370-5381 (2019)


Article DOI: 10.1021/acs.jmedchem.8b02027
More data for this
Ligand-Target Pair