GPCRdb

PACLITAXEL

Agent/drug
Bioactivity

PACLITAXEL

No image available

SMILES	CC(=O)O[C@H]1C(=O)[C@]2(C)[C@@H](O)C[C@H]3OC[C@@]3(OC(C)=O)[C@H]2[C@H](OC(=O)c2ccccc2)[C@]2(O)C[C@H](OC(=O)[C@H](O)[C@@H](NC(=O)c3ccccc3)c3ccccc3)C(C)=C1C2(C)C
InChIKey	RCINICONZNJXQF-MZXODVADSA-N

Chemical Properties

Hydrogen bond acceptors	14
Hydrogen bond donors	4
Rotatable bonds	10
Molecular weight (Da)	853.3

Database connections

ChEMBL_compound_ids PubChem PubChem GPCRdb

Bioactivities

Affinity
Potency

Search:

Receptor					Activity				Source

Protein	Gene	Species	Family	Class	Type	Min	Avg	Max	Database

δ	OPRD	Human	Opioid	A	pKi	5.83	5.83	5.83	ChEMBL
δ	OPRD	Human	Opioid	A	pKi	8.23	8.23	8.23	Drug Central
CCK₁	CCKAR	Human	Cholecystokinin	A	pKi	5.64	5.64	5.64	ChEMBL
CCK₁	CCKAR	Human	Cholecystokinin	A	pKi	8.25	8.25	8.25	Drug Central
MC₅	MC5R	Human	Melanocortin	A	pKi	4.79	4.79	4.79	ChEMBL
MC₅	MC5R	Human	Melanocortin	A	pKi	8.32	8.32	8.32	Drug Central
NK₂	NK2R	Human	Tachykinin	A	pKi	5.69	5.69	5.69	ChEMBL
NK₂	NK2R	Human	Tachykinin	A	pKi	8.24	8.24	8.24	Drug Central

Showing 1 to 8 of 8 entries

Search:

Receptor					Activity				Source

Protein	Gene	Species	Family	Class	Type	Min	Avg	Max	Database

δ	OPRD	Human	Opioid	A	pIC50	5.38	5.38	5.38	ChEMBL
CCK₁	CCKAR	Human	Cholecystokinin	A	pIC50	4.94	4.94	4.94	ChEMBL
MC₅	MC5R	Human	Melanocortin	A	pIC50	4.77	4.77	4.77	ChEMBL
NK₂	NK2R	Human	Tachykinin	A	pIC50	5.21	5.21	5.21	ChEMBL
NPS	NPSR1	Human	Neuropeptide S	A	Potency	4.90	4.90	4.90	ChEMBL

Showing 1 to 5 of 5 entries

PACLITAXEL

No image available

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

Database connections

ChEMBL_compound_ids PubChem PubChem GPCRdb

Compound is not listed as a drug.