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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	Apelin receptor
Species	Homo sapiens (Human)
Gene	APLNR
Synonym	msr/apj GPCR34 G-protein coupled receptor HG11 G-protein coupled receptor APJ AGTRL1 angiotensin II receptor-like 1 angiotensin receptor-like 1 APJR APJ apelin receptor B78 [ Show all ]
Disease	N/A
Length	380
Amino acid sequence	MEEGGDFDNYYGADNQSECEYTDWKSSGALIPAIYMLVFLLGTTGNGLVLWTVFRSSREKRRSADIFIASLAVADLTFVVTLPLWATYTYRDYDWPFGTFFCKLSSYLIFVNMYASVFCLTGLSFDRYLAIVRPVANARLRLRVSGAVATAVLWVLAALLAMPVMVLRTTGDLENTTKVQCYMDYSMVATVSSEWAWEVGLGVSSTTVGFVVPFTIMLTCYFFIAQTIAGHFRKERIEGLRKRRRLLSIIVVLVVTFALCWMPYHLVKTLYMLGSLLHWPCDFDLFLMNIFPYCTCISYVNSCLNPFLYAFFDPRFRQACTSMLCCGQSRCAGTSHSSSGEKSASYSSGHSQGPGPNMGKGGEQMHEKSIPYSQETLVVD
UniProt	P35414
Protein Data Bank	5vbl
GPCR-HGmod model	P35414
3D structure model	This structure is from PDB ID 5vbl.
BioLiP	BL0380094, BL0380093
Therapeutic Target Database	N/A
ChEMBL	CHEMBL1628481
IUPHAR	36
DrugBank	N/A

Ligand

Name	2-chloro-N-[[phenyl(pyridin-2-yl)methylidene]amino]benzamide
Molecular formula	C19H14ClN3O
IUPAC name	2-chloro-N-[[phenyl(pyridin-2-yl)methylidene]amino]benzamide
Molecular weight	335.791
Hydrogen bond acceptor	3
Hydrogen bond donor	1
XlogP	4.6
Synonyms	2-chloro-N-[[phenyl(2-pyridinyl)methylidene]amino]benzamide ZINC252598402 cid_840497 2-chloro-N-[[phenyl(2-pyridyl)methylene]amino]benzamide AC1LHMTU 2-chloranyl-N-[[phenyl(pyridin-2-yl)methylidene]amino]benzamide MCULE-4713697963 BDBM67374 [ Show all ]
Inchi Key	CZUSCKWTXPKQFZ-UHFFFAOYSA-N
Inchi ID	InChI=1S/C19H14ClN3O/c20-16-11-5-4-10-15(16)19(24)23-22-18(14-8-2-1-3-9-14)17-12-6-7-13-21-17/h1-13H,(H,23,24)
PubChem CID	840497
ChEMBL	N/A
IUPHAR	N/A
BindingDB	67374
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	<40000.0 nM	N/A	BindingDB

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