BindingDB logo
myBDB logout

null

SMILES: [O-][N+](=O)c1cnc(Cl)nc1NC1CCCCC1

InChI Key: InChIKey=HYWUBWDYBHATQI-UHFFFAOYSA-N

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50461106   
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
Peptidyl-prolyl cis-trans isomerase NIMA-interacting 1


(Homo sapiens (Human))		BDBM50461106
PNG
(CHEMBL4226104)
Show SMILES [O-][N+](=O)c1cnc(Cl)nc1NC1CCCCC1
Show InChI InChI=1S/C10H13ClN4O2/c11-10-12-6-8(15(16)17)9(14-10)13-7-4-2-1-3-5-7/h6-7H,1-5H2,(H,12,13,14)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a>1.00E+5n/an/an/an/an/an/a



Chinese Academy of Medical Sciences & Peking Union Medical College

Curated by ChEMBL


Assay Description
Inhibition of human N-terminal His6-tagged Pin1 PPIase activity expressed in Escherichia coli BL21 using Suc-Ala-Glu-cis-Pro-Phe-4-nitroanilide as su...

Bioorg Med Chem 26: 2186-2197 (2018)


Article DOI: 10.1016/j.bmc.2018.03.024
BindingDB Entry DOI: 10.7270/Q2RN3BH0
More data for this
Ligand-Target Pair