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GLASS

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GPCR

Name	Melanin-concentrating hormone receptor 1
Species	Homo sapiens (Human)
Gene	MCHR1
Synonym	SLC-1 Somatostatin receptor-like protein MCHR-1 MCHR MCH1R MCH1 receptor MCH-R1 MCH-1R MCH receptor 1 GPR24 G-protein coupled receptor 24 G protein-coupled receptor 24 [ Show all ]
Disease	Obesity Obesity; Anxiety; Depression
Length	422
Amino acid sequence	MSVGAMKKGVGRAVGLGGGSGCQATEEDPLPNCGACAPGQGGRRWRLPQPAWVEGSSARLWEQATGTGWMDLEASLLPTGPNASNTSDGPDNLTSAGSPPRTGSISYINIIMPSVFGTICLLGIIGNSTVIFAVVKKSKLHWCNNVPDIFIINLSVVDLLFLLGMPFMIHQLMGNGVWHFGETMCTLITAMDANSQFTSTYILTAMAIDRYLATVHPISSTKFRKPSVATLVICLLWALSFISITPVWLYARLIPFPGGAVGCGIRLPNPDTDLYWFTLYQFFLAFALPFVVITAAYVRILQRMTSSVAPASQRSIRLRTKRVTRTAIAICLVFFVCWAPYYVLQLTQLSISRPTLTFVYLYNAAISLGYANSCLNPFVYIVLCETFRKRLVLSVKPAAQGQLRAVSNAQTADEERTESKGT
UniProt	Q99705
Protein Data Bank	N/A
GPCR-HGmod model	Q99705
3D structure model	This predicted structure model is from GPCR-EXP Q99705.
BioLiP	N/A
Therapeutic Target Database	T09572
ChEMBL	CHEMBL344
IUPHAR	280
DrugBank	BE0003478

Ligand

Name	SMR000131465
Molecular formula	C22H26N2O3
IUPAC name	N-cyclooctyl-2-(furan-2-ylmethyl)-3-oxo-1H-isoindole-1-carboxamide
Molecular weight	366.461
Hydrogen bond acceptor	3
Hydrogen bond donor	1
XlogP	4.0
Synonyms	HMS2445K18 SR-01000144718-1 AC1NCRJB N-cyclooctyl-2-(2-furfuryl)-3-keto-isoindoline-1-carboxamide CCG-34419 cid_4516225 MLS000521056 AKOS002127284 N-cyclooctyl-2-(furan-2-ylmethyl)-3-oxidanylidene-1H-isoindole-1-carboxamide SR-01000144718 EU-0097503 N-cyclooctyl-2-(2-furanylmethyl)-3-oxo-1H-isoindole-1-carboxamide BDBM62082 N-cyclooctyl-2-(furan-2-ylmethyl)-3-oxo-1H-isoindole-1-carboxamide CHEMBL1565197 [ Show all ]
Inchi Key	CZHKNIVNMCJKFB-UHFFFAOYSA-N
Inchi ID	InChI=1S/C22H26N2O3/c25-21(23-16-9-4-2-1-3-5-10-16)20-18-12-6-7-13-19(18)22(26)24(20)15-17-11-8-14-27-17/h6-8,11-14,16,20H,1-5,9-10,15H2,(H,23,25)
PubChem CID	4516225
ChEMBL	CHEMBL1565197
IUPHAR	N/A
BindingDB	62082
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	<43807.0 nM	PubChem BioAssay data set	ChEMBL

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