JQ1

Basic Information

CAS ID:	1268524-70-4
Molecular Formula:	C23H25ClN4O2S
Molecular Weight:	457 g/mol
Monoisotopic Mass:	456.1387 g/mol
Class:	Small Molecule
Natural Product:	No
Other Names:
Analysis:	Drug repositioning mechanism analysis

Compound Structure and Identifier

InChI:	InChI=1S/C23H25ClN4O2S/c1-12-13(2)31-22-19(12)20(15-7-9-16(24)10-8-15)25-17(11-18(29)30-23(4,5)6)21-27-26-14(3)28(21)22/h7-10,17H,11H2,1-6H3/t17-/m0/s1	See All
InChI Key:	DNVXATUJJDPFDM-KRWDZBQOSA-N
Smiles:	Cc1sc2c(C(=N[C@@H](CC(=O)OC(C)(C)C)c3nnc(C)n23)c4ccc(Cl)cc4)c1C	See All
Molfile:	Download

Related Target

Target ID	Name	Interaction
T0681	Bromodomain-containing protein 4	antagonist

Related Fibrosis Property

Reference Record 1

PubMed ID	28063381	Target ID	T0681
Uniprot ID	Bromodomain-containing protein 4	Name	Bromodomain-containing protein 4
Model	vitro,rat	Fibrosis Disease	Renal fibrosis
Process I
Process II
Process III	prevenet collagen deposition
Mechanism	Targeting TGF-β-Nox4-ROS

Reference Record 2

PubMed ID	27793799	Target ID	T0681
Uniprot ID	Bromodomain-containing protein 4	Name	Bromodomain-containing protein 4
Model	vitro,mice	Fibrosis Disease	Pulmonary fibrosis
Process I
Process II	EMT
Process III	prevenet collagen deposition
Mechanism	Targeting NF-κB-dependent

Reference Record 3

PubMed ID	27240956	Target ID	T0681
Uniprot ID	Bromodomain-containing protein 4	Name	Bromodomain-containing protein 4
Model	vitro	Fibrosis Disease	Cystic fibrosis
Process I
Process II
Process III
Mechanism	Targeting CXCL8

Reference Record 4

PubMed ID	26644586	Target ID	T0681
Uniprot ID	Bromodomain-containing protein 4	Name	Bromodomain-containing protein 4
Model	vitro,mice	Fibrosis Disease	Liver fibrosis
Process I
Process II	HSCs activation
Process III
Mechanism

Related Link

PubChem:	46907787
ChEMBL:	CHEMBL1957266