GPCRdb

PPTN-NC

Agent/drug
Bioactivity

PPTN-NC

SMILES	Cc1c(C(=O)O)cc(-c2ccc(C3CCNCC3)cc2)c2ccc(-c3ccc(C(F)(F)F)cc3)cc12
InChIKey	MDSNOUPPFQBVBS-UHFFFAOYSA-N

Chemical Properties

Hydrogen bond acceptors	None
Hydrogen bond donors	None
Rotatable bonds	None
Molecular weight (Da)

Database connections

ChEMBL_compound_ids ChEMBL_compound_ids GPCRdb

Bioactivities

Affinity
Potency

Search:

Receptor					Activity				Source

Protein	Gene	Species	Family	Class	Type	Min	Avg	Max	Database

α_1B	ADA1B	Human	Adrenoceptors	A	pKi	5.44	5.44	5.44	ChEMBL
α_2B	ADA2B	Human	Adrenoceptors	A	pKi	5.74	5.74	5.74	ChEMBL
β₃	ADRB3	Human	Adrenoceptors	A	pKi	5.49	5.49	5.49	ChEMBL
D₁	DRD1	Human	Dopamine	A	pKi	5.67	5.67	5.67	ChEMBL
D₅	DRD5	Human	Dopamine	A	pKi	5.54	5.54	5.54	ChEMBL
P2Y₁₄	P2Y14	Human	P2Y	A	pKi	5.07	5.07	5.07	ChEMBL

Showing 1 to 6 of 6 entries

Search:

Receptor					Activity				Source

Protein	Gene	Species	Family	Class	Type	Min	Avg	Max	Database

P2Y₁₄	P2Y14	Human	P2Y	A	pIC50	5.36	5.36	5.36	ChEMBL

Showing 1 to 1 of 1 entry

PPTN-NC

Drug properties

Molecular type	Na
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 ChEMBL_compound_ids GPCRdb

Compound is not listed as a drug.