GPCRdb

salmeterol

Agent/drug
Bioactivity

salmeterol

SMILES	OCc1cc(C(O)CNCCCCCCOCCCCc2ccccc2)ccc1O
InChIKey	GIIZNNXWQWCKIB-UHFFFAOYSA-N

Chemical Properties

Hydrogen bond acceptors	5
Hydrogen bond donors	4
Rotatable bonds	16
Molecular weight (Da)	415.3

Database connections

PubChem Guide To Pharmacology ChEMBL_compound_ids DrugBank Drug Central PubChem GPCRdb
Structure pdb	6MXT
Ligand site mutations	β₂

Bioactivities

Affinity
Potency

Search:

Receptor					Activity				Source

Protein	Gene	Species	Family	Class	Type	Min	Avg	Max	Database

α_1A	ADA1A	Human	Adrenoceptors	A	pKi	6.26	6.26	6.26	ChEMBL
α_1D	ADA1D	Human	Adrenoceptors	A	pKi	6.02	6.02	6.02	ChEMBL
α_2B	ADA2B	Human	Adrenoceptors	A	pKi	5.71	5.71	5.71	ChEMBL
β₁	ADRB1	Mouse	Adrenoceptors	A	pKi	6.26	6.26	6.26	ChEMBL
β₁	ADRB1	Human	Adrenoceptors	A	pKi	5.60	5.92	6.16	ChEMBL
β₁	ADRB1	Human	Adrenoceptors	A	pKi	5.80	7.01	8.21	PDSP Ki database
β₁	ADRB1	Human	Adrenoceptors	A	pKi	8.21	8.21	8.21	Drug Central
β₁	ADRB1	Mouse	Adrenoceptors	A	pKi	8.20	8.20	8.20	Drug Central
β₂	ADRB2	Human	Adrenoceptors	A	pKi	6.80	8.05	9.30	Guide to Pharmacology
β₂	ADRB2	Human	Adrenoceptors	A	pKi	6.74	8.70	9.74	ChEMBL
β₂	ADRB2	Human	Adrenoceptors	A	pKd	5.96	7.74	9.52	ChEMBL
β₂	ADRB2	Human	Adrenoceptors	A	pKi	7.60	8.16	9.41	PDSP Ki database
β₂	ADRB2	Human	Adrenoceptors	A	pKi	8.03	8.03	8.03	Drug Central
β₃	ADRB3	Human	Adrenoceptors	A	pKi	5.14	6.70	8.25	PDSP Ki database
5-HT_1B	5HT1B	Human	5-Hydroxytryptamine	A	pKi	5.70	5.70	5.70	ChEMBL
5-HT_1D	5HT1D	Human	5-Hydroxytryptamine	A	pKi	5.99	5.99	5.99	ChEMBL
5-HT_2A	5HT2A	Human	5-Hydroxytryptamine	A	pKi	5.89	5.89	5.89	ChEMBL
5-HT_2C	5HT2C	Human	5-Hydroxytryptamine	A	pKi	5.39	5.39	5.39	ChEMBL
5-HT₇	5HT7R	Human	5-Hydroxytryptamine	A	pKi	6.59	6.59	6.59	ChEMBL
D₂	DRD2	Human	Dopamine	A	pKi	4.50	4.50	4.50	ChEMBL

Showing 1 to 20 of 25 entries

Search:

Receptor					Activity				Source

Protein	Gene	Species	Family	Class	Type	Min	Avg	Max	Database

β₁	B0FL73	Guinea pig	Adrenoceptors	A	pEC50	8.30	8.30	8.30	ChEMBL
β₁	ADRB1	Human	Adrenoceptors	A	pEC50	5.30	6.29	7.17	ChEMBL
β₁	ADRB1	Human	Adrenoceptors	A	pIC50	6.30	6.30	6.30	ChEMBL
β₂	ADRB2	Human	Adrenoceptors	A	pEC50	9.20	9.55	9.90	Guide to Pharmacology
β₂	ADRB2	Guinea pig	Adrenoceptors	A	pIC50	8.46	8.46	8.46	ChEMBL
β₂	ADRB2	Guinea pig	Adrenoceptors	A	pEC50	7.50	8.17	8.57	ChEMBL
β₂	ADRB2	Human	Adrenoceptors	A	pEC50	8.35	9.56	10.35	ChEMBL
β₂	ADRB2	Human	Adrenoceptors	A	pIC50	7.83	8.07	8.30	ChEMBL
β₂	ADRB2	Guinea pig	Adrenoceptors	A	pEC50	8.12	8.12	8.12	Drug Central
β₃	ADRB3	Human	Adrenoceptors	A	pEC50	5.90	5.93	6.00	ChEMBL
β₃	ADRB3	Human	Adrenoceptors	A	pEC50	8.22	8.22	8.22	Drug Central
ADGRF1	AGRF1	Human	ADGRF	B2	pIC50	5.47	5.47	5.47	ChEMBL
CX₃CR1	CX3C1	Human	Chemokine	A	pIC50	5.50	5.50	5.50	ChEMBL
FPR3	FPR3	Human	Formylpeptide	A	pIC50	5.25	5.25	5.25	ChEMBL
GPR183	GP183	Human	A orphans	A	pIC50	5.37	5.37	5.37	ChEMBL
GPR65	PSYR	Human	A orphans	A	pIC50	5.61	5.61	5.61	ChEMBL
M₁	ACM1	Rat	Acetylcholine (muscarinic)	A	Potency	4.95	4.95	4.95	ChEMBL

Showing 1 to 17 of 17 entries

salmeterol

Drug properties

Molecular type	Small molecule
Physiological/Surrogate	Surrogate
Approved drug	Yes

Clinical Trials

Phase I 0

Phase II 0

Phase III 1

Approved Yes

Database connections

PubChem Guide To Pharmacology ChEMBL_compound_ids DrugBank Drug Central PubChem GPCRdb
Structure pdb	6MXT
Ligand site mutations	β₂

Sankey plot

Drug Information

Search:

Target					Disease				Phase

Gene	Protein	Receptor family	Ligand type	Class	Indication name	ICD11	ATC	Association score	Phase	Approved

ADRB2	β₂-adrenoceptor	Adrenoceptors	Aminergic receptors	Class A	Asthma	CA23	R03A	0.612	4	Yes
ADRB2	β₂-adrenoceptor	Adrenoceptors	Aminergic receptors	Class A	Chronic bronchitis, unspecified	CA20.1Z	R03A	0.593	4	Yes
ADRB2	β₂-adrenoceptor	Adrenoceptors	Aminergic receptors	Class A	Chronic obstructive pulmonary disease, unspecified	CA22.Z	R03A	0.632	4	Yes
ADRB2	β₂-adrenoceptor	Adrenoceptors	Aminergic receptors	Class A	Emphysema, unspecified	CA21.Z	R03A	0.602	4	Yes
ADRB2	β₂-adrenoceptor	Adrenoceptors	Aminergic receptors	Class A	Other specified chronic bronchiolitis	CA26.Y	R03A	0.336	3	Yes

Showing 1 to 5 of 5 entries