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BDBM225374 Chk1_135

SMILES: CCc1ccc(CCOc2cc3Cc4c(n[nH]c4-c4ccc(cc4)-c4ccc(O)cc4)-c3cc2OC)nc1

InChI Key: InChIKey=JEVGZWNOZXXJPR-UHFFFAOYSA-N

Data: 1 KI

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 = 225374   
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
CHK1_Kinase


(Homo sapiens (Human))
BDBM225374
PNG
(Chk1_135)
Show SMILES CCc1ccc(CCOc2cc3Cc4c(n[nH]c4-c4ccc(cc4)-c4ccc(O)cc4)-c3cc2OC)nc1
Show InChI InChI=1S/C32H29N3O3/c1-3-20-4-11-25(33-19-20)14-15-38-30-17-24-16-28-31(34-35-32(28)27(24)18-29(30)37-2)23-7-5-21(6-8-23)22-9-12-26(36)13-10-22/h4-13,17-19,36H,3,14-16H2,1-2H3,(H,34,35)
PDB

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
D3R
23.1n/an/an/an/an/an/an/an/a



D3R



Assay Description
33P-Radiometric_Method1


D3R 221: (2015)


BindingDB Entry DOI: 10.7270/Q2WS8S4Z
More data for this
Ligand-Target Pair