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GLASS

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Go to the GPCR, ligand, or experimental data tables.
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GPCR

Name	5-hydroxytryptamine receptor 1D
Species	Homo sapiens (Human)
Gene	HTR1D
Synonym	Serotonin 1D alpha receptor serotonin receptor 1D HTRL Htr1db 5-HT-1D 5-HT-1D-alpha 5-HT1D 5-HT1D receptor 5-HT1Dalpha 5-hydroxytryptamine (serotonin) receptor 1D, G protein-coupled Gpcr14 HT1DA [ Show all ]
Disease	Acute migraine Epilepsy Migraine headaches Mood disorder Migraine Major depressive disorder Severe mood disorders [ Show all ]
Length	377
Amino acid sequence	MSPLNQSAEGLPQEASNRSLNATETSEAWDPRTLQALKISLAVVLSVITLATVLSNAFVLTTILLTRKLHTPANYLIGSLATTDLLVSILVMPISIAYTITHTWNFGQILCDIWLSSDITCCTASILHLCVIALDRYWAITDALEYSKRRTAGHAATMIAIVWAISICISIPPLFWRQAKAQEEMSDCLVNTSQISYTIYSTCGAFYIPSVLLIILYGRIYRAARNRILNPPSLYGKRFTTAHLITGSAGSSLCSLNSSLHEGHSHSAGSPLFFNHVKIKLADSALERKRISAARERKATKILGIILGAFIICWLPFFVVSLVLPICRDSCWIHPALFDFFTWLGYLNSLINPIIYTVFNEEFRQAFQKIVPFRKAS
UniProt	P28221
Protein Data Bank	N/A
GPCR-HGmod model	P28221
3D structure model	This predicted structure model is from GPCR-EXP P28221.
BioLiP	N/A
Therapeutic Target Database	T11072
ChEMBL	CHEMBL1983
IUPHAR	3
DrugBank	BE0000659

Ligand

Name	Dipropyl-5-CT
Molecular formula	C17H25N3O
IUPAC name	3-[2-(dipropylamino)ethyl]-1H-indole-5-carboxamide
Molecular weight	287.407
Hydrogen bond acceptor	2
Hydrogen bond donor	2
XlogP	2.2
Synonyms	NCGC00162145-02 ZINC2539820 Biomol-NT_000159 D0D3PZ N,N-Dipropyl-5-carboxamidotryptamine PDSP1_001262 3-[2-(dipropylamino)ethyl]-1H-indole-5-carboxamide CAS_156314 DP5CT NCGC00015310-01 PDSP2_001599 AC1L4FYC Lopac-D-132 NCGC00015310-04 NN-DIPROP-5-CT BPBio1_000662 N,N-Dipropyl-5-carboxamidotryptamine maleate PDSP1_001615 74885-25-9 CCG-204501 GTPL122 NCGC00015310-02 SCHEMBL8891095 BDBM81789 CHEMBL1332062 Lopac0_000408 NCGC00162145-01 NSC_156314 1H-Indole-5-carboxamide, 3-(2-(dipropylamino)ethyl)- BRD-K32645441-001-01-4 DP-5-CT N,N-Dipropylcarboxamidotryptamine PDSP2_001246 CHEBI:92566 L000940 NCGC00015310-03 [ Show all ]
Inchi Key	DPXOFRGRKPFZOD-UHFFFAOYSA-N
Inchi ID	InChI=1S/C17H25N3O/c1-3-8-20(9-4-2)10-7-14-12-19-16-6-5-13(17(18)21)11-15(14)16/h5-6,11-12,19H,3-4,7-10H2,1-2H3,(H2,18,21)
PubChem CID	156314
ChEMBL	CHEMBL1332062
IUPHAR	122
BindingDB	81789
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	12.5893 nM	PMID1565658	IUPHAR
Ki	12.88 nM	PMID7984267	PDSP,BindingDB
Ki	42.0 nM	PMID1565658	PDSP,BindingDB

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