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GLASS

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GPCR

Name	Lutropin-choriogonadotropic hormone receptor
Species	Homo sapiens (Human)
Gene	LHCGR
Synonym	lutropin-choriogonadotropic hormone receptor Luteinizing hormone receptor LSH-R LHR LH/CG-R LH-R LH receptor LGR2 LCGR Choriogonadotropin receptor [ Show all ]
Disease	Heart disease Breast cancer Cancer Myelodysplastic syndrome Female infertility Fertility Leukemia Infertility [ Show all ]
Length	699
Amino acid sequence	MKQRFSALQLLKLLLLLQPPLPRALREALCPEPCNCVPDGALRCPGPTAGLTRLSLAYLPVKVIPSQAFRGLNEVIKIEISQIDSLERIEANAFDNLLNLSEILIQNTKNLRYIEPGAFINLPRLKYLSICNTGIRKFPDVTKVFSSESNFILEICDNLHITTIPGNAFQGMNNESVTLKLYGNGFEEVQSHAFNGTTLTSLELKENVHLEKMHNGAFRGATGPKTLDISSTKLQALPSYGLESIQRLIATSSYSLKKLPSRETFVNLLEATLTYPSHCCAFRNLPTKEQNFSHSISENFSKQCESTVRKVNNKTLYSSMLAESELSGWDYEYGFCLPKTPRCAPEPDAFNPCEDIMGYDFLRVLIWLINILAIMGNMTVLFVLLTSRYKLTVPRFLMCNLSFADFCMGLYLLLIASVDSQTKGQYYNHAIDWQTGSGCSTAGFFTVFASELSVYTLTVITLERWHTITYAIHLDQKLRLRHAILIMLGGWLFSSLIAMLPLVGVSNYMKVSICFPMDVETTLSQVYILTILILNVVAFFIICACYIKIYFAVRNPELMATNKDTKIAKKMAILIFTDFTCMAPISFFAISAAFKVPLITVTNSKVLLVLFYPINSCANPFLYAIFTKTFQRDFFLLLSKFGCCKRRAELYRRKDFSAYTSNCKNGFTGSNKPSQSTLKLSTLHCQGTALLDKTRYTEC
UniProt	P22888
Protein Data Bank	N/A
GPCR-HGmod model	N/A
3D structure model	No available structures or models
BioLiP	N/A
Therapeutic Target Database	T79473
ChEMBL	CHEMBL1854
IUPHAR	N/A
DrugBank	BE0000134

Ligand

Name	MLS001182319
Molecular formula	C12H13N7O2S2
IUPAC name	2-[[5-(2-ethyl-5-methylpyrazol-3-yl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-5-nitro-1,3-thiazole
Molecular weight	351.403
Hydrogen bond acceptor	8
Hydrogen bond donor	0
XlogP	2.1
Synonyms	2-[[5-(2-ethyl-5-methyl-pyrazol-3-yl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-5-nitro-1,3-thiazole SMR000568079 HMS2880I04 SR-01000817011-3 Bio8A11 Oprea1_777931 2-[[5-(2-ethyl-5-methyl-pyrazol-3-yl)-4-methyl-1,2,4-triazol-3-yl]thio]-5-nitro-thiazole CHEMBL1361740 SR-01000817011 AC1MCHZ7 MCULE-3719427866 2-[[5-(2-ethyl-5-methyl-3-pyrazolyl)-4-methyl-1,2,4-triazol-3-yl]thio]-5-nitrothiazole CCG-254997 REGID_for_CID_2744279 2-[[5-(2-ethyl-5-methylpyrazol-3-yl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-5-nitro-1,3-thiazole cid_2744279 SR-01000817011-2 BDBM58440 [ Show all ]
Inchi Key	LAJNPBGTUNSKGJ-UHFFFAOYSA-N
Inchi ID	InChI=1S/C12H13N7O2S2/c1-4-18-8(5-7(2)16-18)10-14-15-11(17(10)3)23-12-13-6-9(22-12)19(20)21/h5-6H,4H2,1-3H3
PubChem CID	2744279
ChEMBL	CHEMBL1361740
IUPHAR	N/A
BindingDB	58440
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand satisfies Lipinski's rule of five.

Experimental Data

Parameter	Value	Reference	Database source
Potency	37933.0 nM	PubChem BioAssay data set	ChEMBL

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