ArrestinDb

doxepin

Agent/drug
Bioactivity

doxepin

SMILES	CN(C)CC/C=C1\c2ccccc2COc2ccccc21
InChIKey	ODQWQRRAPPTVAG-GZTJUZNOSA-N

Chemical Properties

Hydrogen bond acceptors	2
Hydrogen bond donors	0
Rotatable bonds	3
Molecular weight (Da)	279.2

Database connections

PubChem Guide To Pharmacology ChEMBL_compound_ids DrugBank Guide To Pharmacology PubChem GPCRdb
Structure pdb	3RZE
Ligand site mutations	H₁

Search:

Receptor					Activity				Source

Protein	Gene	Species	Family	Class	Type	Min	Avg	Max	Database

α_1A	ADA1A	Human	Adrenoceptors	A	pKi	8.12	8.12	8.12	Drug Central
α_1B	ADA1B	Rat	Adrenoceptors	A	pKi	8.13	8.13	8.13	Drug Central
α_1D	ADA1D	Human	Adrenoceptors	A	pKi	8.13	8.13	8.13	Drug Central
α_2A	ADA2A	Human	Adrenoceptors	A	pKi	8.20	8.20	8.20	Drug Central
5-HT_1A	5HT1A	Human	5-Hydroxytryptamine	A	pKi	6.56	6.56	6.56	PDSP Ki database
5-HT_1A	5HT1A	Human	5-Hydroxytryptamine	A	pKi	8.18	8.18	8.18	Drug Central
5-HT_2B	5HT2B	Human	5-Hydroxytryptamine	A	pKi	7.60	7.60	7.60	ChEMBL
5-HT_2C	5HT2C	Rat	5-Hydroxytryptamine	A	pKi	8.06	8.06	8.06	PDSP Ki database
5-HT₆	5HT6R	Rat	5-Hydroxytryptamine	A	pKi	6.87	6.87	6.87	PDSP Ki database
5-HT₆	5HT6R	Human	5-Hydroxytryptamine	A	pKi	8.16	8.16	8.16	Drug Central
D₂	DRD2	Human	Dopamine	A	pKi	6.44	6.44	6.44	PDSP Ki database
D₃	DRD3	Human	Dopamine	A	pKi	8.20	8.20	8.20	Drug Central
H₁	HRH1	Human	Histamine	A	pKi	9.75	9.75	9.75	ChEMBL
H₁	HRH1	Human	Histamine	A	pKi	9.31	9.66	10.05	PDSP Ki database
H₁	HRH1	Rat	Histamine	A	pKi	9.15	9.15	9.15	PDSP Ki database
H₁	HRH1	Guinea pig	Histamine	A	pKi	9.30	9.55	9.80	PDSP Ki database
H₁	HRH1	Human	Histamine	A	pKi	8.01	8.01	8.01	Drug Central
H₁	HRH1	Human	Histamine	A	pKd	9.00	9.00	9.00	Guide to Pharmacology
H₁	HRH1	Human	Histamine	A	pKi	9.50	9.75	10.00	Guide to Pharmacology
H₂	HRH2	Human	Histamine	A	pKi	8.24	8.24	8.24	Drug Central

Showing 1 to 20 of 31 entries

Search:

Receptor					Activity				Source

Protein	Gene	Species	Family	Class	Type	Min	Avg	Max	Database

α_1A	ADA1A	Rat	Adrenoceptors	A	pIC50	7.96	7.96	7.96	Drug Central
α_2B	ADA2B	Human	Adrenoceptors	A	pIC50	8.14	8.14	8.14	Drug Central
α_2C	ADA2C	Human	Adrenoceptors	A	pIC50	8.15	8.15	8.15	Drug Central
5-HT_2A	5HT2A	Human	5-Hydroxytryptamine	A	pEC50	8.13	8.13	8.13	Drug Central
5-HT_2B	5HT2B	Human	5-Hydroxytryptamine	A	pEC50	8.14	8.14	8.14	Drug Central
5-HT_2C	5HT2C	Human	5-Hydroxytryptamine	A	pEC50	8.15	8.15	8.15	Drug Central
D₁	DRD1	Human	Dopamine	A	pEC50	8.19	8.19	8.19	Drug Central
D₂	DRD2	Human	Dopamine	A	pEC50	8.19	8.19	8.19	Drug Central
H₄	HRH4	Human	Histamine	A	pEC50	8.17	8.17	8.17	Drug Central
M₁	ACM1	Rat	Acetylcholine (muscarinic)	A	Potency	6.05	6.45	6.85	ChEMBL
TSH	TSHR	Human	Glycoprotein hormone	A	Potency	8.70	8.70	8.70	ChEMBL

Showing 1 to 11 of 11 entries

doxepin

Drug properties

Molecular type	Small molecule
Physiological/Surrogate	Surrogate
Approved drug	Yes

Clinical Trials

Phase I 0

Phase II 6

Phase III 4

Approved Yes

Database connections

PubChem Guide To Pharmacology ChEMBL_compound_ids DrugBank Guide To Pharmacology PubChem GPCRdb
Structure pdb	3RZE
Ligand site mutations	H₁

Sankey plot

Drug Information

Search:

Target					Disease				Phase

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

HRH1	H₁ receptor	Histamine receptors	Aminergic receptors	Class A	Alcohol dependence, unspecified	6C40.2Z	D04A, N06A	0.103	4	Yes
HRH1	H₁ receptor	Histamine receptors	Aminergic receptors	Class A	Anxiety	MB24.3	D04A, N06A	0.545	4	Yes
HRH1	H₁ receptor	Histamine receptors	Aminergic receptors	Class A	Atopic eczema, unspecified	EA80.Z	D04A, N06A	0.474	4	Yes
HRH1	H₁ receptor	Histamine receptors	Aminergic receptors	Class A	Bipolar type I disorder, unspecified	6A60.Z	D04A, N06A	0.003	4	Yes
HRH1	H₁ receptor	Histamine receptors	Aminergic receptors	Class A	Depressive disorders, unspecified	6A7Z	D04A, N06A	0.478	4	Yes
HRH1	H₁ receptor	Histamine receptors	Aminergic receptors	Class A	Dermatitis or eczema, unspecified	EA8Z	D04A, N06A	0.375	2	Yes
HRH1	H₁ receptor	Histamine receptors	Aminergic receptors	Class A	Insomnia disorders, unspecified	7A0Z	D04A, N06A	0.579	4	Yes
HRH1	H₁ receptor	Histamine receptors	Aminergic receptors	Class A	Irritable bowel syndrome, type unspecified	DD91.0Z	D04A, N06A	0.494	2	Yes
HRH1	H₁ receptor	Histamine receptors	Aminergic receptors	Class A	Oral mucositis	DA01.11	D04A, N06A	0.259	3	Yes
HRH1	H₁ receptor	Histamine receptors	Aminergic receptors	Class A	Pruritus, unspecified	EC90.Z	D04A, N06A	0.602	4	Yes
HRH1	H₁ receptor	Histamine receptors	Aminergic receptors	Class A	Sleep-wake disorders, unspecified	7B2Z	D04A, N06A	0.050	2	Yes
HRH1	H₁ receptor	Histamine receptors	Aminergic receptors	Class A	Urticaria of unspecified type	EB05	D04A, N06A	0.606	3	Yes
HRH2	H₂ receptor	Histamine receptors	Aminergic receptors	Class A	Anxiety	MB24.3	D04A, N06A	0.008	4	Yes
HRH2	H₂ receptor	Histamine receptors	Aminergic receptors	Class A	Atopic eczema, unspecified	EA80.Z	D04A, N06A	0.259	4	Yes
HRH2	H₂ receptor	Histamine receptors	Aminergic receptors	Class A	Dermatitis or eczema, unspecified	EA8Z	D04A, N06A	0.002	2	Yes
HRH2	H₂ receptor	Histamine receptors	Aminergic receptors	Class A	Pruritus, unspecified	EC90.Z	D04A, N06A	0.001	4	Yes
HRH2	H₂ receptor	Histamine receptors	Aminergic receptors	Class A	Urticaria of unspecified type	EB05	D04A, N06A	0.008	3	Yes

Showing 1 to 17 of 17 entries

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doxepin

doxepin

Chemical Properties

Database connections

Bioactivities

doxepin

Drug properties

Clinical Trials

Database connections

Sankey plot

Drug Information