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GLASS

You can:

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	Substance-P receptor
Species	Cavia porcellus (Guinea pig)
Gene	TACR1
Synonym	NK-1 receptor NK-1R SPR Tachykinin receptor 1
Disease	N/A for non-human GPCRs
Length	407
Amino acid sequence	MDNVLPVDSDLFPNISTNTSEPNQFVQPAWQIVLWAAAYTVIVVTSVVGNVVVMWIILAHKRMRTVTNYFLVNLAFAEASMAAFNTVVNFTYAVHNEWYYGLFYCKFHNFFPIAAVFASIYSMTAVAFDRYMAIIHPLQPRLSATATKVVICVIWVLALLLAFPQGYYSTTETMPGRVVCMIEWPSHPDKIYEKVYHICVTVLIYFLPLLVIGYAYTVVGITLWASEIPGDSSDRYHEQVSAKRKVVKMMIVVVCTFAICWLPFHIFFLLPYINPDLYLKKFIQQVYLAIMWLAMSSTMYNPIIYCCLNDRFRLGFKHAFRCCPFISAADYEGLEMKSTRYFQTQGSVYKVSRLETTISTVVGAHEEDPEEGPKATPSSLDLTSNGSSRSNSKTVTESSSFYSNMLS
UniProt	P30547
Protein Data Bank	N/A
GPCR-HGmod model	N/A
3D structure model	No available structures or models
BioLiP	N/A
Therapeutic Target Database	N/A
ChEMBL	CHEMBL3942
IUPHAR	N/A
DrugBank	N/A

Ligand

Name	CHEMBL293726
Molecular formula	C35H38N4O7
IUPAC name	benzyl (2S)-2-[[(2R)-3-(1-formylindol-3-yl)-2-[[2-[(2-methylpropan-2-yl)oxycarbonylamino]acetyl]amino]propanoyl]amino]-3-phenylpropanoate
Molecular weight	626.71
Hydrogen bond acceptor	7
Hydrogen bond donor	3
XlogP	5.0
Synonyms	BDBM50002555 benzyl 2-[2-(1-formyl-1H-3-indolyl)-1-neopentylcarboxamidomethylcarboxamido-(1R)-ethylcarboxamido]-3-phenyl-(2S)-propanoate N-Boc-Gly-1-Formyl-D-Trp-L-Phe-OBzl
Inchi Key	ALEZIIVECUFDMT-WDYNHAJCSA-N
Inchi ID	InChI=1S/C35H38N4O7/c1-35(2,3)46-34(44)36-20-31(41)37-28(19-26-21-39(23-40)30-17-11-10-16-27(26)30)32(42)38-29(18-24-12-6-4-7-13-24)33(43)45-22-25-14-8-5-9-15-25/h4-17,21,23,28-29H,18-20,22H2,1-3H3,(H,36,44)(H,37,41)(H,38,42)/t28-,29+/m1/s1
PubChem CID	15755299
ChEMBL	CHEMBL293726
IUPHAR	N/A
BindingDB	50002555
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand is heavier than 500 daltons.

Experimental Data

Parameter	Value	Reference	Database source
IC50	420.0 nM	PMID1375965	BindingDB,ChEMBL

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