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Details

Stereochemistry ACHIRAL
Molecular Formula C22H19BrN6O
Molecular Weight 463.33
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ABT-702

SMILES

NC1=C2C(=CC(=NC2=NC=N1)C3=CC=C(N=C3)N4CCOCC4)C5=CC=CC(Br)=C5

InChI

InChIKey=RQCXKDWOCUJWQZ-UHFFFAOYSA-N
InChI=1S/C22H19BrN6O/c23-16-3-1-2-14(10-16)17-11-18(28-22-20(17)21(24)26-13-27-22)15-4-5-19(25-12-15)29-6-8-30-9-7-29/h1-5,10-13H,6-9H2,(H2,24,26,27,28)

HIDE SMILES / InChI

Molecular Formula C22H19BrN6O
Molecular Weight 463.33
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Targets

Targets

Primary TargetPharmacologyConditionPotency
1.5 nM [IC50]
1.3 nM [IC50]
PubMed

PubMed

TitleDatePubMed
Inhibition of Antiapoptotic BCL-XL, BCL-2, and MCL-1 Proteins by Small Molecule Mimetics.
2010-08-12
4-amino-5-aryl-6-arylethynylpyrimidines: structure-activity relationships of non-nucleoside adenosine kinase inhibitors.
2007-02-15
5-(3-Bromophenyl)-7-(6-morpholin-4-ylpyridin-3-yl)pyrido[2,3-d]pyrimidin-4-ylamine: structure-activity relationships of 7-substituted heteroaryl analogs as non-nucleoside adenosine kinase inhibitors.
2005-06-01
Pharmacological characterization of the chronic constriction injury model of neuropathic pain.
2004-05-03
Discovery of 4-amino-5-(3-bromophenyl)-7-(6-morpholino-pyridin-3-yl)pyrido[2,3-d]pyrimidine, an orally active, non-nucleoside adenosine kinase inhibitor..
2001-06-21
ABT-702 (4-amino-5-(3-bromophenyl)-7-(6-morpholinopyridin-3-yl)pyrido[2, 3-d]pyrimidine), a novel orally effective adenosine kinase inhibitor with analgesic and anti-inflammatory properties: I. In vitro characterization and acute antinociceptive effects in the mouse.
2000-12
Substance Class Chemical
Created
by admin
on Mon Mar 31 18:25:43 GMT 2025
Edited
by admin
on Mon Mar 31 18:25:43 GMT 2025
Record UNII
2P206WS5B3
Record Status Validated (UNII)
Record Version
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Name Type Language
ABT-702
Common Name English
PYRIDO(2,3-D)PYRIMIDIN-4-AMINE, 5-(3-BROMOPHENYL)-7-(6-(4-MORPHOLINYL)-3-PYRIDINYL)-
Preferred Name English
Code System Code Type Description
PUBCHEM
1973
Created by admin on Mon Mar 31 18:25:43 GMT 2025 , Edited by admin on Mon Mar 31 18:25:43 GMT 2025
PRIMARY
FDA UNII
2P206WS5B3
Created by admin on Mon Mar 31 18:25:43 GMT 2025 , Edited by admin on Mon Mar 31 18:25:43 GMT 2025
PRIMARY
CAS
214697-26-4
Created by admin on Mon Mar 31 18:25:43 GMT 2025 , Edited by admin on Mon Mar 31 18:25:43 GMT 2025
PRIMARY
EPA CompTox
DTXSID901017168
Created by admin on Mon Mar 31 18:25:43 GMT 2025 , Edited by admin on Mon Mar 31 18:25:43 GMT 2025
PRIMARY
Related Record Type Details
ACTIVE MOIETY