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SMILES: OCCOCCN1CCN(CC1)C1=C(Cl)C(=O)N(C1=O)c1ccnc(Cl)c1

InChI Key: InChIKey=OAWDUZFYDZZULP-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 = 39182   
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
Bcl-2-related protein A1


(Mus musculus (Mouse))
BDBM39182
PNG
(3-chloranyl-1-(2-chloranylpyridin-4-yl)-4-[4-[2-(2...)
Show SMILES OCCOCCN1CCN(CC1)C1=C(Cl)C(=O)N(C1=O)c1ccnc(Cl)c1 |c:13|
Show InChI InChI=1S/C17H20Cl2N4O4/c18-13-11-12(1-2-20-13)23-16(25)14(19)15(17(23)26)22-5-3-21(4-6-22)7-9-27-10-8-24/h1-2,11,24H,3-10H2
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 2.05E+4n/an/an/an/an/an/a



Sanford-Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


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


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q2K072NW
More data for this
Ligand-Target Pair
Bcl-2-related protein A1


(Mus musculus (Mouse))
BDBM39182
PNG
(3-chloranyl-1-(2-chloranylpyridin-4-yl)-4-[4-[2-(2...)
Show SMILES OCCOCCN1CCN(CC1)C1=C(Cl)C(=O)N(C1=O)c1ccnc(Cl)c1 |c:13|
Show InChI InChI=1S/C17H20Cl2N4O4/c18-13-11-12(1-2-20-13)23-16(25)14(19)15(17(23)26)22-5-3-21(4-6-22)7-9-27-10-8-24/h1-2,11,24H,3-10H2
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 3.32E+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/Q2X065GM
More data for this
Ligand-Target Pair