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SMILES: Cc1cc(C)c2nc(N3CCCN(CC3)C(=O)c3ccco3)c(cc2c1)C#N

InChI Key: InChIKey=XCZAIVOWTDVZCX-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 2 hits for monomerid = 44425   
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
Ephrin type-A receptor 4


(Mus musculus)
BDBM44425
PNG
(2-[4-(2-furoyl)-1,4-diazepan-1-yl]-6,8-dimethyl-qu...)
Show SMILES Cc1cc(C)c2nc(N3CCCN(CC3)C(=O)c3ccco3)c(cc2c1)C#N
Show InChI InChI=1S/C22H22N4O2/c1-15-11-16(2)20-17(12-15)13-18(14-23)21(24-20)25-6-4-7-26(9-8-25)22(27)19-5-3-10-28-19/h3,5,10-13H,4,6-9H2,1-2H3
PDB
MMDB

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KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a>5.00E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Sanford-Burnham Center for Chemical Genomics (SBCCG) Sanford-Burnham Medical Research Institute (SBMRI, San Diego, CA) NIH Molecular Libraries Screen...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q2JD4V5T
More data for this
Ligand-Target Pair
Ephrin type-A receptor 4


(Mus musculus)
BDBM44425
PNG
(2-[4-(2-furoyl)-1,4-diazepan-1-yl]-6,8-dimethyl-qu...)
Show SMILES Cc1cc(C)c2nc(N3CCCN(CC3)C(=O)c3ccco3)c(cc2c1)C#N
Show InChI InChI=1S/C22H22N4O2/c1-15-11-16(2)20-17(12-15)13-18(14-23)21(24-20)25-6-4-7-26(9-8-25)22(27)19-5-3-10-28-19/h3,5,10-13H,4,6-9H2,1-2H3
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 1.66E+4n/an/an/an/an/an/a



Sanford-Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q2P55KW4
More data for this
Ligand-Target Pair