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GLASS

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GPCR

Name	Histamine H1 receptor
Species	Homo sapiens (Human)
Gene	HRH1
Synonym	HH1R H1R Hisr H1 receptor
Disease	Vertigo's disease; Meniere's disease Ocular allergy Obesity Nausea; Vomiting Insomnia; Anxiety disorder Insomnia Hypersensitivity reactions; Coughs; Common colds Pain Parkinson's disease Perennial and seasonal allergic rhinitis; Vasomotor rhinitis; Allergic conjunctivitis Vertigo meniere's disease Unspecified Sleep disorders Seasonal and perennial allergic rhinitis and vasomotor rhinitis Rhinitis; Urticaria; Allergy Rhinitis Respiratory disease Respiratory allergies; Cancer Respiratory allergies; Allergic rhinitis Pruritus Nasal congestion Hay fever; Cough Hay fever; Allergic rhinitis Anxiety disorder Anesthesia Allergy Allergic skin disorders Allergic rhinitis; Urticaria; Pruritus Allergic rhinitis; Urticaria Allergic rhinitis Allergic disorders; Itching; Nausea Allergic conjunctivitis Anxiety disorder; Morning sickness Asthma Hay fever Common cold; Allergies Depression Dry cough [ Show all ]
Length	487
Amino acid sequence	MSLPNSSCLLEDKMCEGNKTTMASPQLMPLVVVLSTICLVTVGLNLLVLYAVRSERKLHTVGNLYIVSLSVADLIVGAVVMPMNILYLLMSKWSLGRPLCLFWLSMDYVASTASIFSVFILCIDRYRSVQQPLRYLKYRTKTRASATILGAWFLSFLWVIPILGWNHFMQQTSVRREDKCETDFYDVTWFKVMTAIINFYLPTLLMLWFYAKIYKAVRQHCQHRELINRSLPSFSEIKLRPENPKGDAKKPGKESPWEVLKRKPKDAGGGSVLKSPSQTPKEMKSPVVFSQEDDREVDKLYCFPLDIVHMQAAAEGSSRDYVAVNRSHGQLKTDEQGLNTHGASEISEDQMLGDSQSFSRTDSDTTTETAPGKGKLRSGSNTGLDYIKFTWKRLRSHSRQYVSGLHMNRERKAAKQLGFIMAAFILCWIPYFIFFMVIAFCKNCCNEHLHMFTIWLGYINSTLNPLIYPLCNENFKKTFKRILHIRS
UniProt	P35367
Protein Data Bank	3rze
GPCR-HGmod model	P35367
3D structure model	This structure is from PDB ID 3rze.
BioLiP	BL0202178, BL0202179, BL0202180
Therapeutic Target Database	T77913
ChEMBL	CHEMBL231
IUPHAR	262
DrugBank	BE0000442

Ligand

Name	N-Methyl-3,3-diphenylpropylamine
Molecular formula	C16H19N
IUPAC name	N-methyl-3,3-diphenylpropan-1-amine
Molecular weight	225.335
Hydrogen bond acceptor	1
Hydrogen bond donor	1
XlogP	3.6
Synonyms	EINECS 248-821-5 n-methyl-3,3-diphenylpropan-1-amin W-107076 28075-29-8 AJ-55404 KB-58594 P938 A819315 API0005069 D02GNN N-methyl-3,3-diphenyl-1-propanamine SCHEMBL3638413 (3,3-Diphenylpropyl)methylamine ACM28075298 Benzenepropanamine,N-methyl-g-phenyl- Diphenylpropyl-methylamin FT-0649309 N-methyl-3,3-diphenylpropan-1-amine ZINC5996308 3,3-Diphenyl-N-methylpropylamine AKEGHAUFMKCWGX-UHFFFAOYSA-N CHEMBL593494 Methyl(3,3-diphenylpropyl)amine RL02949 AC1L3PJ5 AX8019936 DB-049781 N-methyl-3,3-diphenyl-propan-1-amine TL8002235 075M298 ACT07251 C-36655 DTXSID00182350 Jsp005413 AKOS015964873 CTK4G0777 MolPort-003-737-089 SC-20531 AC1Q1HZ6 BDBM35933 diphenylalkylamine (DPA), 5b [ Show all ]
Inchi Key	AKEGHAUFMKCWGX-UHFFFAOYSA-N
Inchi ID	InChI=1S/C16H19N/c1-17-13-12-16(14-8-4-2-5-9-14)15-10-6-3-7-11-15/h2-11,16-17H,12-13H2,1H3
PubChem CID	119812
ChEMBL	CHEMBL593494
IUPHAR	N/A
BindingDB	35933
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand satisfies Lipinski's rule of five.

Experimental Data

Parameter	Value	Reference	Database source
Ki	64.0 nM	PMID19700330	BindingDB,ChEMBL

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