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BDBM50465580 CHEMBL4276791

SMILES: COc1cccc(c1)C(=O)NCc1cc(ccc1N(C)C)-c1cn2CCCc2n1

InChI Key: InChIKey=NYCQMHOKYBUOQV-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 = 50465580   
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
WD repeat-containing protein 5 (WDR5)


(Homo sapiens (Human))
BDBM50465580
PNG
(CHEMBL4276791)
Show SMILES COc1cccc(c1)C(=O)NCc1cc(ccc1N(C)C)-c1cn2CCCc2n1
Show InChI InChI=1S/C23H26N4O2/c1-26(2)21-10-9-16(20-15-27-11-5-8-22(27)25-20)12-18(21)14-24-23(28)17-6-4-7-19(13-17)29-3/h4,6-7,9-10,12-13,15H,5,8,11,14H2,1-3H3,(H,24,28)
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
185n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Binding affinity to N-terminal 6x-His-SUMO tagged WDR5 delta23 deletion mutant (24 to 334 residues) (unknown origin) expressed in Escherichia coli BL...


J Med Chem 61: 5623-5642 (2018)


Article DOI: 10.1021/acs.jmedchem.8b00375
BindingDB Entry DOI: 10.7270/Q2KD21KT
More data for this
Ligand-Target Pair