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BDBM50526424 CHEMBL4555451

SMILES: Cc1cc2c(cccc2n1-c1nc2CCOCc2c(NCc2ccccc2)n1)C(=O)NCC#C

InChI Key: InChIKey=XSTFXNDJLIPCIT-UHFFFAOYSA-N

Data: 1 KI

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50526424   
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
Transitional endoplasmic reticulum ATPase


(Homo sapiens (Human))		BDBM50526424
PNG
(CHEMBL4555451)
Show SMILES Cc1cc2c(cccc2n1-c1nc2CCOCc2c(NCc2ccccc2)n1)C(=O)NCC#C
Show InChI InChI=1S/C27H25N5O2/c1-3-13-28-26(33)20-10-7-11-24-21(20)15-18(2)32(24)27-30-23-12-14-34-17-22(23)25(31-27)29-16-19-8-5-4-6-9-19/h1,4-11,15H,12-14,16-17H2,2H3,(H,28,33)(H,29,30,31)
PDB

KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
antibodypedia
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PC cid
PC sid
UniChem
Article
PubMed
 19n/an/an/an/an/an/an/an/a



University of Minnesota

Curated by ChEMBL


Assay Description
Inhibition of His-tagged p97 (unknown origin) in presence of ATP and PNP by UV-transparent microplate assay

J Med Chem 62: 2814-2829 (2019)


Article DOI: 10.1021/acs.jmedchem.9b00144
More data for this
Ligand-Target Pair