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GLASS

You can:

Check the ligand table for details.
Go to the GPCR list to see GPCRs with which this ligand interacts.
Go to the individual GPCR page for PubMed ID information by text mining.
Download a TSV version of all interaction data.
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Ligand

Name	CHEMBL3775707
Molecular formula	C191H306N54O52S2
IUPAC name	(4S)-4-[[(2S)-2-[[(2S)-2-[[(2S)-2-[2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2R)-2-[[(2S,3R)-2-[[(2S)-2-[[(2S)-2-acetamido-3-carboxypropanoyl]amino]-4-methylpentanoyl]amino]-3-hydroxybutanoyl]amino]-3-phenylpropanoyl]amino]-3-(1H-imidazol-5-yl)propanoyl]amino]-4-methylpentanoyl]amino]-4-methylpentanoyl]amino]-5-carbamimidamidopentanoyl]amino]-4-carboxybutanoyl]amino]-3-methylbutanoyl]amino]-4-methylpentanoyl]amino]-4-carboxybutanoyl]amino]hexanoylamino]propanoyl]amino]-5-carbamimidamidopentanoyl]amino]propanoyl]amino]-5-[[(2S)-5-amino-1-[[1-[[(2S)-1-[[(2S)-5-amino-1-[[(8R)-5-[[(2S)-4-amino-1-[[(2S)-1-[[(2S)-6-amino-1-[[(2S)-1-[[1-[[(2S)-1-[[1-[[(2S,3S)-1-amino-3-methyl-1-oxopentan-2-yl]amino]-2,4-dimethyl-1-oxopentan-2-yl]amino]-4-carboxy-1-oxobutan-2-yl]amino]-1-oxohexan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]amino]-1-oxohexan-2-yl]amino]-5-carbamimidamido-1-oxopentan-2-yl]amino]-1,4-dioxobutan-2-yl]carbamoyl]-8-[[4-(carbamoylamino)phenyl]methyl]-11-[[4-[[(4S)-2,6-dioxo-1,3-diazinane-4-carbonyl]amino]phenyl]methyl]-7,10,13-trioxo-1,2-dithia-6,9,12-triazacyclohexadec-14-yl]amino]-1,5-dioxopentan-2-yl]amino]-1-oxopropan-2-yl]amino]-2,4-dimethyl-1-oxopentan-2-yl]amino]-1,5-dioxopentan-2-yl]amino]-5-oxopentanoic acid
Molecular weight	4255.0
Hydrogen bond acceptor	59
Hydrogen bond donor	59
XlogP	-5.4
Synonyms	BDBM50153493
Inchi Key	HJWZTTOXMPJREB-FZJVLVEJSA-N
Inchi ID	InChI=1S/C191H306N54O52S2/c1-28-31-43-113(218-163(274)121(60-66-144(254)255)224-170(281)130(80-96(10)11)237-181(292)148(100(18)19)241-166(277)122(61-67-145(256)257)223-159(270)118(48-40-74-207-187(201)202)221-169(280)128(78-94(6)7)230-171(282)129(79-95(8)9)231-175(286)135(85-112-91-204-92-208-112)235-174(285)134(82-107-41-34-33-35-42-107)238-182(293)150(105(24)246)242-178(289)131(81-97(12)13)232-177(288)138(88-147(260)261)212-106(25)247)155(266)209-102(21)152(263)215-116(46-38-72-205-185(197)198)156(267)210-103(22)153(264)217-120(59-65-143(252)253)162(273)225-123(58-64-140(194)249)179(290)244-190(26,89-98(14)15)183(294)211-104(23)154(265)216-119(57-63-139(193)248)161(272)227-125-69-75-298-299-76-70-126(228-172(283)132(83-109-51-55-111(56-52-109)214-188(203)296)234-173(284)133(233-164(125)275)84-108-49-53-110(54-50-108)213-167(278)137-87-142(251)240-189(297)239-137)165(276)236-136(86-141(195)250)176(287)222-117(47-39-73-206-186(199)200)158(269)219-115(45-36-37-71-192)160(271)229-127(77-93(4)5)168(279)220-114(44-32-29-2)157(268)226-124(62-68-146(258)259)180(291)245-191(27,90-99(16)17)184(295)243-149(151(196)262)101(20)30-3/h33-35,41-42,49-56,91-105,113-138,148-150,246H,28-32,36-40,43-48,57-90,192H2,1-27H3,(H2,193,248)(H2,194,249)(H2,195,250)(H2,196,262)(H,204,208)(H,209,266)(H,210,267)(H,211,294)(H,212,247)(H,213,278)(H,215,263)(H,216,265)(H,217,264)(H,218,274)(H,219,269)(H,220,279)(H,221,280)(H,222,287)(H,223,270)(H,224,281)(H,225,273)(H,226,268)(H,227,272)(H,228,283)(H,229,271)(H,230,282)(H,231,286)(H,232,288)(H,233,275)(H,234,284)(H,235,285)(H,236,276)(H,237,292)(H,238,293)(H,241,277)(H,242,289)(H,243,295)(H,244,290)(H,245,291)(H,252,253)(H,254,255)(H,256,257)(H,258,259)(H,260,261)(H4,197,198,205)(H4,199,200,206)(H4,201,202,207)(H3,203,214,296)(H2,239,240,251,297)/t101-,102-,103-,104-,105+,113?,114?,115-,116-,117-,118-,119-,120-,121-,122-,123-,124-,125?,126?,127-,128-,129-,130-,131-,132+,133?,134+,135-,136-,137-,138-,148-,149-,150-,190?,191?/m0/s1
PubChem CID	127034112
ChEMBL	CHEMBL3775707
IUPHAR	N/A
BindingDB	50153493
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand has more than 5 hydrogen bond donor. This ligand has more than 10 hydrogen bond acceptor. This ligand is heavier than 500 daltons.

Known GPCRs

You can:

Click GLASS IDs to check the association information.
Click protein names to check details of the GPCRs.
Download a TSV version of all interaction information.

GLASS ID	Name	UniProt	Gene	Species	Length
524904	Corticotropin-releasing factor receptor 1	P34998	CRHR1	Homo sapiens (Human)	444
524903	Corticotropin-releasing factor receptor 2	Q60748	Crhr2	Mus musculus (Mouse)	411

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