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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.
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Go to the ligand page and check other GPCRs which it interacts with.
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GPCR

Name	C3a anaphylatoxin chemotactic receptor
Species	Homo sapiens (Human)
Gene	C3AR1
Synonym	C3a anaphylatoxin chemotactic receptor C3a receptor C3AR anaphylatoxin C3a receptor complement component 3a receptor 1 C3a-R [ Show all ]
Disease	N/A
Length	482
Amino acid sequence	MASFSAETNSTDLLSQPWNEPPVILSMVILSLTFLLGLPGNGLVLWVAGLKMQRTVNTIWFLHLTLADLLCCLSLPFSLAHLALQGQWPYGRFLCKLIPSIIVLNMFASVFLLTAISLDRCLVVFKPIWCQNHRNVGMACSICGCIWVVAFVMCIPVFVYREIFTTDNHNRCGYKFGLSSSLDYPDFYGDPLENRSLENIVQPPGEMNDRLDPSSFQTNDHPWTVPTVFQPQTFQRPSADSLPRGSARLTSQNLYSNVFKPADVVSPKIPSGFPIEDHETSPLDNSDAFLSTHLKLFPSASSNSFYESELPQGFQDYYNLGQFTDDDQVPTPLVAITITRLVVGFLLPSVIMIACYSFIVFRMQRGRFAKSQSKTFRVAVVVVAVFLVCWTPYHIFGVLSLLTDPETPLGKTLMSWDHVCIALASANSCFNPFLYALLGKDFRKKARQSIQGILEAAFSEELTRSTHCPSNNVISERNSTTV
UniProt	Q16581
Protein Data Bank	N/A
GPCR-HGmod model	Q16581
3D structure model	This predicted structure model is from GPCR-EXP Q16581.
BioLiP	N/A
Therapeutic Target Database	N/A
ChEMBL	CHEMBL4761
IUPHAR	31
DrugBank	N/A

Ligand

Name	CHEMBL96138
Molecular formula	C26H26N4O
IUPAC name	N-[1,3-bis[(4-methylphenyl)methylimino]isoindol-5-yl]acetamide
Molecular weight	410.521
Hydrogen bond acceptor	3
Hydrogen bond donor	2
XlogP	4.2
Synonyms	BDBM50105664 N,N'-Bis(4-methylbenzyl)-5-(acetylamino)isoindoline-1,3-diimine N-{3-[(E)-4-Methyl-benzylimino]-1-[(Z)-4-methyl-benzylimino]-2,3-dihydro-1H-isoindol-5-yl}-acetamide
Inchi Key	LHOJPONVWDSHCT-UHFFFAOYSA-N
Inchi ID	InChI=1S/C26H26N4O/c1-17-4-8-20(9-5-17)15-27-25-23-13-12-22(29-19(3)31)14-24(23)26(30-25)28-16-21-10-6-18(2)7-11-21/h4-14H,15-16H2,1-3H3,(H,29,31)(H,27,28,30)
PubChem CID	136110895
ChEMBL	CHEMBL96138
IUPHAR	N/A
BindingDB	50105664
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	32000.0 nM	PMID11597407	BindingDB,ChEMBL

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