GPCRdb

CHEMBL1084009

Agent/drug
Bioactivity

CHEMBL1084009

SMILES	O=C(O)c1ccc(C2(NC(=O)c3cccc4ccn(Cc5ccc(C(F)(F)F)cc5)c34)CC2)cc1
InChIKey	BWXAZFCPGFKANL-UHFFFAOYSA-N

Chemical Properties

Hydrogen bond acceptors	3
Hydrogen bond donors	2
Rotatable bonds	6
Molecular weight (Da)	478.2

Database connections

ChEMBL_compound_ids PubChem GPCRdb

Bioactivities

Affinity
Potency

Search:

Receptor					Activity				Source

Protein	Gene	Species	Family	Class	Type	Min	Avg	Max	Database

DP₁	PD2R	Human	Prostanoid	A	pKi	5.78	5.78	5.78	ChEMBL
EP₁	PE2R1	Human	Prostanoid	A	pKi	4.70	4.70	4.70	ChEMBL
EP₂	PE2R2	Human	Prostanoid	A	pKi	5.10	5.10	5.10	ChEMBL
EP₃	PE2R3	Human	Prostanoid	A	pKi	5.13	5.13	5.13	ChEMBL
EP₄	PE2R4	Human	Prostanoid	A	pKi	9.47	9.55	9.64	ChEMBL
FP	PF2R	Human	Prostanoid	A	pKi	5.19	5.19	5.19	ChEMBL
TP	TA2R	Human	Prostanoid	A	pKi	5.17	5.17	5.17	ChEMBL

Showing 1 to 7 of 7 entries

Search:

Receptor					Activity				Source

Protein	Gene	Species	Family	Class	Type	Min	Avg	Max	Database

EP₄	PE2R4	Human	Prostanoid	A	pIC50	8.02	8.55	8.89	ChEMBL

Showing 1 to 1 of 1 entry

CHEMBL1084009

Drug properties

Molecular type	Small molecule
Physiological/Surrogate	Surrogate
Approved drug	No

Distribution across phases (no. indications)

Phase I 0

Phase II 0

Phase III 0

Phase IV 0

Database connections

ChEMBL_compound_ids PubChem GPCRdb

Compound is not listed as a drug.