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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	Oxytocin receptor
Species	Homo sapiens (Human)
Gene	OXTR
Synonym	OTR OT-R OT receptor
Disease	Threatened pre-term labour Postpartum haemorrhage Premature ejaculation Miscarriage Female sexual dysfunction Erectile dysfunction Autism Androgen decline [ Show all ]
Length	389
Amino acid sequence	MEGALAANWSAEAANASAAPPGAEGNRTAGPPRRNEALARVEVAVLCLILLLALSGNACVLLALRTTRQKHSRLFFFMKHLSIADLVVAVFQVLPQLLWDITFRFYGPDLLCRLVKYLQVVGMFASTYLLLLMSLDRCLAICQPLRSLRRRTDRLAVLATWLGCLVASAPQVHIFSLREVADGVFDCWAVFIQPWGPKAYITWITLAVYIVPVIVLAACYGLISFKIWQNLRLKTAAAAAAEAPEGAAAGDGGRVALARVSSVKLISKAKIRTVKMTFIIVLAFIVCWTPFFFVQMWSVWDANAPKEASAFIIVMLLASLNSCCNPWIYMLFTGHLFHELVQRFLCCSASYLKGRRLGETSASKKSNSSSFVLSHRSSSQRSCSQPSTA
UniProt	P30559
Protein Data Bank	N/A
GPCR-HGmod model	P30559
3D structure model	This predicted structure model is from GPCR-EXP P30559.
BioLiP	N/A
Therapeutic Target Database	T84486
ChEMBL	CHEMBL2049
IUPHAR	369
DrugBank	BE0000844

Ligand

Name	CHEMBL24353
Molecular formula	C27H29Cl2N5O5
IUPAC name	N-[1-[2-[[(2S)-1-amino-3-(3,4-dichlorophenyl)-1-oxopropan-2-yl]amino]-2-oxoethyl]-5-methyl-2-oxo-3H-1,4-benzodiazepin-3-yl]-5-oxohexanamide
Molecular weight	574.459
Hydrogen bond acceptor	6
Hydrogen bond donor	3
XlogP	1.9
Synonyms	BDBM50218609
Inchi Key	AKLZJTDTARMCIF-GVNKFJBHSA-N
Inchi ID	InChI=1S/C27H29Cl2N5O5/c1-15(35)6-5-9-23(36)33-26-27(39)34(22-8-4-3-7-18(22)16(2)31-26)14-24(37)32-21(25(30)38)13-17-10-11-19(28)20(29)12-17/h3-4,7-8,10-12,21,26H,5-6,9,13-14H2,1-2H3,(H2,30,38)(H,32,37)(H,33,36)/t21-,26?/m0/s1
PubChem CID	44275002
ChEMBL	CHEMBL24353
IUPHAR	N/A
BindingDB	50218609
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand is heavier than 500 daltons.

Experimental Data

Parameter	Value	Reference	Database source
Ki	199.53 nM	PMID11392542	ChEMBL
Ki	200.0 nM	PMID11392542	BindingDB

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