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GLASS

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

Name	5-hydroxytryptamine receptor 7
Species	Homo sapiens (Human)
Gene	HTR7
Synonym	5-HT-7 Serotonin receptor 7 5-HT-X 5-HT1Y 5-HT7 GPRFO 5-HT7 receptor 5-HTx 5-hydroxytryptamine (serotonin) receptor 7, adenylate cyclase-coupled [ Show all ]
Disease	Sleep disorders Schizophrenia Major depressive disorder
Length	479
Amino acid sequence	MMDVNSSGRPDLYGHLRSFLLPEVGRGLPDLSPDGGADPVAGSWAPHLLSEVTASPAPTWDAPPDNASGCGEQINYGRVEKVVIGSILTLITLLTIAGNCLVVISVCFVKKLRQPSNYLIVSLALADLSVAVAVMPFVSVTDLIGGKWIFGHFFCNVFIAMDVMCCTASIMTLCVISIDRYLGITRPLTYPVRQNGKCMAKMILSVWLLSASITLPPLFGWAQNVNDDKVCLISQDFGYTIYSTAVAFYIPMSVMLFMYYQIYKAARKSAAKHKFPGFPRVEPDSVIALNGIVKLQKEVEECANLSRLLKHERKNISIFKREQKAATTLGIIVGAFTVCWLPFFLLSTARPFICGTSCSCIPLWVERTFLWLGYANSLINPFIYAFFNRDLRTTYRSLLQCQYRNINRKLSAAGMHEALKLAERPERPEFVLRACTRRVLLRPEKRPPVSVWVLQSPDHHNWLADKMLTTVEKKVMIHD
UniProt	P34969
Protein Data Bank	N/A
GPCR-HGmod model	P34969
3D structure model	This predicted structure model is from GPCR-EXP P34969.
BioLiP	N/A
Therapeutic Target Database	T79062
ChEMBL	CHEMBL3155
IUPHAR	12
DrugBank	BE0000650, BE0004862

Ligand

Name	CHEMBL3984812
Molecular formula	C25H27ClN2O2
IUPAC name	1-[[4-chloro-3-(2-methoxyphenyl)phenyl]methyl]-4-(2-methoxyphenyl)piperazine
Molecular weight	422.953
Hydrogen bond acceptor	4
Hydrogen bond donor	0
XlogP	5.5
Synonyms	BDBM50204666
Inchi Key	APJODNDBBZDIBK-UHFFFAOYSA-N
Inchi ID	InChI=1S/C25H27ClN2O2/c1-29-24-9-5-3-7-20(24)21-17-19(11-12-22(21)26)18-27-13-15-28(16-14-27)23-8-4-6-10-25(23)30-2/h3-12,17H,13-16,18H2,1-2H3
PubChem CID	134157289
ChEMBL	CHEMBL3984812
IUPHAR	N/A
BindingDB	50204666
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
Emax	-7.72 %	PMID27475109	ChEMBL
IC50	22908.7 nM	PMID27475109	ChEMBL
IC50	22909.0 nM	PMID27475109	BindingDB
IC50	23100.0 nM	PMID27475109	BindingDB,ChEMBL
Imax	91.03 %	PMID27475109	ChEMBL
Ki	73.0 nM	PMID27475109	BindingDB,ChEMBL

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