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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	5-hydroxytryptamine receptor 1E
Species	Homo sapiens (Human)
Gene	HTR1E
Synonym	5-hydroxytryptamine (serotonin) receptor 1E, G protein-coupled 5-HT1E_alpha 5-ht1e receptor 5-HT1E 5-HT-1E S31 Serotonin receptor 1E [ Show all ]
Disease	N/A
Length	365
Amino acid sequence	MNITNCTTEASMAIRPKTITEKMLICMTLVVITTLTTLLNLAVIMAIGTTKKLHQPANYLICSLAVTDLLVAVLVMPLSIIYIVMDRWKLGYFLCEVWLSVDMTCCTCSILHLCVIALDRYWAITNAIEYARKRTAKRAALMILTVWTISIFISMPPLFWRSHRRLSPPPSQCTIQHDHVIYTIYSTLGAFYIPLTLILILYYRIYHAAKSLYQKRGSSRHLSNRSTDSQNSFASCKLTQTFCVSDFSTSDPTTEFEKFHASIRIPPFDNDLDHPGERQQISSTRERKAARILGLILGAFILSWLPFFIKELIVGLSIYTVSSEVADFLTWLGYVNSLINPLLYTSFNEDFKLAFKKLIRCREHT
UniProt	P28566
Protein Data Bank	N/A
GPCR-HGmod model	P28566
3D structure model	This predicted structure model is from GPCR-EXP P28566.
BioLiP	N/A
Therapeutic Target Database	N/A
ChEMBL	CHEMBL2182
IUPHAR	4
DrugBank	BE0000476

Ligand

Name	MLS000048662
Molecular formula	C18H27N4O3P
IUPAC name	4-[morpholin-4-yl-(2-propylindazol-3-yl)phosphoryl]morpholine
Molecular weight	378.413
Hydrogen bond acceptor	6
Hydrogen bond donor	0
XlogP	1.5
Synonyms	AC1M5NQX MCULE-3580733897 ZINC3214213 MolPort-004-243-441 4-[morpholin-4-yl-(2-propylindazol-3-yl)phosphoryl]morpholine HMS1769K21 SR-01000025634 AKOS030659056 CHEMBL1313785 Oprea1_710654 4-[morpholino-(2-propylindazol-3-yl)phosphoryl]morpholine HMS2466K09 SR-01000025634-1 BDBM31345 MLS002637202 4-[4-morpholinyl-(2-propyl-3-indazolyl)phosphoryl]morpholine cid_2332584 SMR000060003 [ Show all ]
Inchi Key	DHJIOBQWVKWKQO-UHFFFAOYSA-N
Inchi ID	InChI=1S/C18H27N4O3P/c1-2-7-22-18(16-5-3-4-6-17(16)19-22)26(23,20-8-12-24-13-9-20)21-10-14-25-15-11-21/h3-6H,2,7-15H2,1H3
PubChem CID	2332584
ChEMBL	CHEMBL1313785
IUPHAR	N/A
BindingDB	31345
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	<50000.0 nM	PubChem BioAssay data set	ChEMBL
IC50	50000.0 nM	N/A	BindingDB

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