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GLASS

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Go to the GPCR, ligand, or experimental data tables.
Go to the experimental data table for text mining information in PubMed ID column.
Go to the GPCR page and check other ligands which interact with it.
Go to the ligand page and check other GPCRs which it interacts with.
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GPCR

Name	Neuropeptide Y receptor type 5
Species	Mus musculus (Mouse)
Gene	Npy5r
Synonym	food intake receptor neuropeptide Y receptor type 5 NPY-Y5 receptor NPY5-R NPYY5-R Y5 receptor [ Show all ]
Disease	N/A for non-human GPCRs
Length	466
Amino acid sequence	MEVKLEEHFNKTFVTENNTAASQNTASPAWEDYRGTENNTSAARNTAFPVWEDYRGSVDDLQYFLIGLYTFVSLLGFMGNLLILMAVMKKRNQKTTVNFLIGNLAFSDILVVLFCSPFTLTSVLLDQWMFGKAMCHIMPFLQCVSVLVSTLILISIAIVRYHMIKHPISNNLTANHGYFLIATVWTLGFAICSPLPVFHSLVELKETFGSALLSSKYLCVESWPSDSYRIAFTISLLLVQYILPLVCLTVSHTSVCRSISCGLSHKENRLEENEMINLTLHPSKKSRDQAKPPSTQKWSYSFIRKHRRRYSKKTACVLPAPAGPSQEKHLTVPENPGSVRSQLSPSSKVIPGVPICFEVKPEESSDAQEMRVKRSLTRIKKRSRSVFYRLTILILVFAVSWMPLHVFHVVTDFNDNLISNRHFKLVYCICHLLGMMSCCLNPILYGFLNNGIKADLRALIHCLHMS
UniProt	O70342
Protein Data Bank	N/A
GPCR-HGmod model	N/A
3D structure model	No available structures or models
BioLiP	N/A
Therapeutic Target Database	N/A
ChEMBL	CHEMBL3802
IUPHAR	N/A
DrugBank	N/A

Ligand

Name	CHEMBL1585484
Molecular formula	C18H18ClN3O3S2
IUPAC name	4-[[2-[(3-chlorophenyl)methylsulfanyl]-3H-benzimidazol-5-yl]sulfonyl]morpholine
Molecular weight	423.93
Hydrogen bond acceptor	6
Hydrogen bond donor	1
XlogP	3.2
Synonyms	2-{[(3-chlorophenyl)methyl]sulfanyl}-5-(morpholine-4-sulfonyl)-1H-1,3-benzodiazole Z56811143 MLS000336698 BDBM50365416 SCHEMBL13586989 379707-79-6 HMS2578K05 ZINC6131218 AC1M5B01 MolPort-003-999-312 SMR000244013 4-[[2-[(3-chlorophenyl)methylsulfanyl]-3H-benzimidazol-5-yl]sulfonyl]morpholine MCULE-3660172726 AKOS034457254 Oprea1_373596 [ Show all ]
Inchi Key	BBEBKAGLYIMBCE-UHFFFAOYSA-N
Inchi ID	InChI=1S/C18H18ClN3O3S2/c19-14-3-1-2-13(10-14)12-26-18-20-16-5-4-15(11-17(16)21-18)27(23,24)22-6-8-25-9-7-22/h1-5,10-11H,6-9,12H2,(H,20,21)
PubChem CID	2350190
ChEMBL	CHEMBL1585484
IUPHAR	N/A
BindingDB	50365416
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	19.8 nM	PMID23206862, PMID22853998	ChEMBL
IC50	20.0 nM	PMID22300657, PMID23206862, PMID22853998	BindingDB,ChEMBL

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