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GLASS

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

Name	Pituitary adenylate cyclase-activating polypeptide type I receptor
Species	Homo sapiens (Human)
Gene	ADCYAP1R1
Synonym	PACAPR1 pituitary adenylate cyclase activating polypeptide 1 receptor (1) PACAP1-R PACAP-R1 PACAP-R-1 PACAP type IA receptor PACAP type I receptor PACAP receptor 1 PAC1R PAC1 receptor adenylate cyclase activating polypeptide 1 receptor type 1 adenylate cyclase activating polypeptide 1 receptor 1 PVR1 [ Show all ]
Disease	N/A
Length	468
Amino acid sequence	MAGVVHVSLAALLLLPMAPAMHSDCIFKKEQAMCLEKIQRANELMGFNDSSPGCPGMWDNITCWKPAHVGEMVLVSCPELFRIFNPDQVWETETIGESDFGDSNSLDLSDMGVVSRNCTEDGWSEPFPHYFDACGFDEYESETGDQDYYYLSVKALYTVGYSTSLVTLTTAMVILCRFRKLHCTRNFIHMNLFVSFMLRAISVFIKDWILYAEQDSNHCFISTVECKAVMVFFHYCVVSNYFWLFIEGLYLFTLLVETFFPERRYFYWYTIIGWGTPTVCVTVWATLRLYFDDTGCWDMNDSTALWWVIKGPVVGSIMVNFVLFIGIIVILVQKLQSPDMGGNESSIYLRLARSTLLLIPLFGIHYTVFAFSPENVSKRERLVFELGLGSFQGFVVAVLYCFLNGEVQAEIKRKWRSWKVNRYFAVDFKHRHPSLASSGVNGGTQLSILSKSSSQIRMSGLPADNLAT
UniProt	P41586
Protein Data Bank	3n94
GPCR-HGmod model	P41586
3D structure model	This structure is from PDB ID 3n94.
BioLiP	BL0183307
Therapeutic Target Database	N/A
ChEMBL	CHEMBL5399
IUPHAR	370
DrugBank	N/A

Ligand

Name	CHEMBL255824
Molecular formula	C22H16ClF3N2O3
IUPAC name	3-chloro-4-hydroxy-N-[(E)-[3-[[3-(trifluoromethyl)phenyl]methoxy]phenyl]methylideneamino]benzamide
Molecular weight	448.826
Hydrogen bond acceptor	7
Hydrogen bond donor	2
XlogP	5.5
Synonyms	BDBM50374185
Inchi Key	RMRAPHQWSNJEQR-KKMKTNMSSA-N
Inchi ID	InChI=1S/C22H16ClF3N2O3/c23-19-11-16(7-8-20(19)29)21(30)28-27-12-14-3-2-6-18(10-14)31-13-15-4-1-5-17(9-15)22(24,25)26/h1-12,29H,13H2,(H,28,30)/b27-12+
PubChem CID	44453861
ChEMBL	CHEMBL255824
IUPHAR	N/A
BindingDB	50374185
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand has a partition coefficient log P greater than 5.

Experimental Data

Parameter	Value	Reference	Database source
Ki	554.0 nM	PMID18272364	BindingDB,ChEMBL

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