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GLASS

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Go to the GPCR, ligand, or experimental data tables.
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GPCR

Name	Platelet-activating factor receptor
Species	Homo sapiens (Human)
Gene	PTAFR
Synonym	PAFr PAF-R PAF receptor AGEPC receptor
Disease	Nerve injury Ocular allergy Pain Unspecified Psoriasis Septic shock Solid tumours Stroke Thrombocytopenia Thromboembolism Inflammatory disease Inflammatory bowel disease Conjunctivitis Cerebral infarction Cardiac arrhythmias Allergy Asthma Brain ischaemia [ Show all ]
Length	342
Amino acid sequence	MEPHDSSHMDSEFRYTLFPIVYSIIFVLGVIANGYVLWVFARLYPCKKFNEIKIFMVNLTMADMLFLITLPLWIVYYQNQGNWILPKFLCNVAGCLFFINTYCSVAFLGVITYNRFQAVTRPIKTAQANTRKRGISLSLVIWVAIVGAASYFLILDSTNTVPDSAGSGNVTRCFEHYEKGSVPVLIIHIFIVFSFFLVFLIILFCNLVIIRTLLMQPVQQQRNAEVKRRALWMVCTVLAVFIICFVPHHVVQLPWTLAELGFQDSKFHQAINDAHQVTLCLLSTNCVLDPVIYCFLTKKFRKHLTEKFYSMRSSRKCSRATTDTVTEVVVPFNQIPGNSLKN
UniProt	P25105
Protein Data Bank	5zkq, 5zkp
GPCR-HGmod model	P25105
3D structure model	This structure is from PDB ID 5zkq.
BioLiP	BL0417415, BL0417417,BL0417419, BL0417416,BL0417418, BL0417414
Therapeutic Target Database	T87023
ChEMBL	CHEMBL250
IUPHAR	334
DrugBank	BE0005561

Ligand

Name	CHEMBL54068
Molecular formula	C27H28N2O4
IUPAC name	(2E)-5,5-bis(4-methoxyphenyl)-N-[2-(pyridin-3-ylmethoxy)ethyl]penta-2,4-dienamide
Molecular weight	444.531
Hydrogen bond acceptor	5
Hydrogen bond donor	1
XlogP	4.4
Synonyms	5,5-Bis-(4-methoxy-phenyl)-penta-2,4-dienoic acid [2-(pyridin-3-ylmethoxy)-ethyl]-amide SCHEMBL9521055 BDBM50018383 SCHEMBL9521037
Inchi Key	BXIYWFGTRWBYOM-XVNBXDOJSA-N
Inchi ID	InChI=1S/C27H28N2O4/c1-31-24-12-8-22(9-13-24)26(23-10-14-25(32-2)15-11-23)6-3-7-27(30)29-17-18-33-20-21-5-4-16-28-19-21/h3-16,19H,17-18,20H2,1-2H3,(H,29,30)/b7-3+
PubChem CID	14547300
ChEMBL	CHEMBL54068
IUPHAR	N/A
BindingDB	50018383
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand satisfies Lipinski's rule of five.

Experimental Data

Parameter	Value	Reference	Database source
IC50	250.0 nM	PMID2754709	BindingDB,ChEMBL

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