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GPCR

Name	G-protein coupled receptor 35
Species	Mus musculus (Mouse)
Gene	Gpr35
Synonym	G-protein coupled receptor 3 GPR35 KYNA receptor Kynurenic acid receptor
Disease	N/A for non-human GPCRs
Length	307
Amino acid sequence	MNSTTCNSTLTWPASVNNFFIIYSALLLVLGLLLNSVALWVFCYRMHQWTETRIYMTNLAVADLCLLCSLPFVLYSLKYSSSDTPVCQLSQGIYLANRYMSISLVTAIAVDRYVAVRHPLRARELRSPRQAAAVCVALWVIVVTSLVVRWRLGMQEGGFCFSSQTRRNFSTTAFSLLGFYLPLAIVVFCSLQVVTVLSRRPAADVGQAEATQKATHMVWANLAVFVICFLPLHVVLTVQVSLNLNTCAARDTFSRALSITGKLSDTNCCLDAICYYYMAREFQEASKPATSSNTPHKSQDSQILSLT
UniProt	Q9ES90
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	CHEMBL2390813
IUPHAR	102
DrugBank	N/A

Ligand

Name	zaprinast
Molecular formula	C13H13N5O2
IUPAC name	5-(2-propoxyphenyl)-2,6-dihydrotriazolo[4,5-d]pyrimidin-7-one
Molecular weight	271.28
Hydrogen bond acceptor	5
Hydrogen bond donor	2
XlogP	1.6
Synonyms	5-(2-propoxyphenyl)-3,6-dihydrotriazolo[4,5-d]pyrimidin-7-one MLS000859963 AC1L1KZQ NCGC00016105-05 BCBcMAP01_000103 NCGC00261925-01 BSPBio_001348 Prestwick3_000335 SPBio_001313 DSSTox_RID_80761 HMS1791D10 1,4-Dihydro-5-(2-propoxyphenyl)-7H-1,2,3-triazolo[4,5-d]pyrimidine-7-one HMS3370J04 2-(o-Propoxyphenyl)-8-azapurin-6-one KBio2_004313 3-(2-propoxyphenyl)-2,4,7,8,9-pentazabicyclo[4.3.0]nona-1,3,6-trien-5-one LS-156833 Tocris-0947 Zaprinast [BAN:INN] M&B 22,948 6,7-Dihydro-5-(2-propoxyphenyl)-1H-triazolo(4,5-d)pyrimidin-7-on MolPort-004-964-803 AKOS024458708 NCGC00024894-03 BRD-K12516989-001-01-9 NSC757885 CCG-205314 SBI-0051207.P002 CTK8G3814 Spectrum2_001447 EU-0101240 HMS2090L04 HMS501N06 2103AH KBioGR_001583 5-(2-Propoxyphenyl)-1H-[1,2,3]triazolo[4,5-d]pyrimidin-7(4H)-one SR-01000075536-1 Tox21_501240 Zaprinastum 5-(2-propoxyphenyl)-2,3-dihydrotriazolo[4,5-e]pyrimidin-7-one M&B22948 8-Aza-2-(2-propoxyphenyl)-6-purinone NCGC00016105-03 API0000888 NCGC00094481-01 BS0209 Prestwick1_000335 CCG-39177 SMP1_000321 DSSTox_CID_25224 Spectrum5_001023 GXT25D5DS0 1,4-Dihydro-5-(2-propoxyphenyl)-7H-1,2,3-triazolo(4,5-d)pyrimidin-7-one HMS3263H22 2-(2-propoxyphenyl)-8-azapurin-6-one KBio1_000584 3,6-dihydro-5-(2-propoxyphenyl)-7H-1,2,3-triazolo[4,5-d]pyrimidin-7-one Lopac0_001240 SR-01000597480 M & B 22948 5-(2-propoxyphenyl)-3H,4H-[1,2,3]triazolo[4,5-d]pyrimidin-7-one MolPort-003-666-387 AC1Q6AZY NCGC00024894-01 BDBM14363 NINDS_000584 C13H13N5O2 Prestwick_655 CHEMBL28079 SPBio_002290 DTXSID8045224 HMS1921P15 1,4-Dihydro-5-[2-propoxyphenyl]-7H-1,2,3-triazolo[4,5-d]pyrimidine-7-one HMS3402D10 2-o-Propoxyphenyl-8-azapurin-6-on KBio2_006881 37762-06-4 Tox21_110306 Zaprinast [INN:BAN] M&B 22948 6,7-Dihydro-5-(2-propoxyphenyl)-1H-triazolo(4,5-d)pyrimidin-7-on [IUPAC] NCGC00016105-01 AKOS027446368 NCGC00024894-04 BRD-K16542329-001-05-1 Pharmakon1600-01501199 CCG-220335 SCHEMBL50328 D00YPW Spectrum3_000933 FT-0675894 HMS2096C11 2-(2-Propoxyphenyl)-8-aza-6-purinone IDI1_000584 KBioSS_001745 5-(2-propoxyphenyl)-1h-[1,2,3]triazolo[4,5-d]pyrimidin-7-ol SR-01000075536-4 UNII-GXT25D5DS0 Zaprinastum [INN-Latin] 5-(2-propoxyphenyl)-2H,3H,7H-[1,2,3]triazolo[4,5-d]pyrimidin-7-one MFCD00214073 AB00052245_02 NCGC00016105-04 B6516 NCGC00094481-02 BSPBio_000369 Prestwick2_000335 CHEBI:92215 SMR000326822 DSSTox_GSID_45224 Spectrum_001265 HMS1569C11 1,4-Dihydro-5-(2-propoxyphenyl)-7H-1,2,3-triazolo[4,5-d]pyrimidin-7-one HMS3267G07 2-(2-Propyloxyphenyl)-8-azapurin-6-one KBio2_001745 3,6-Dihydro-5-(o-propoxyphenyl)-7H-v-triazolo(4,5-d)pyrimidin-7-one LP01240 SR-01000597480-1 Zaprinast (M&B 22948) M and B 22948 55122-20-8 MolPort-003-983-815 ACM37762064 NCGC00024894-02 BPBio1_000407 NSC-757885 CAS-37762-06-4 REZGGXNDEMKIQB-UHFFFAOYSA-N CTK5A3076 SPECTRUM1501199 EINECS 253-655-1 HMS1989D10 1,4-Dihydro-5-[2-propoxyphenyl]-7H-1,2,3-triazolo[4,5d]pyrimidine-7-one HMS3713C11 2-o-Propoxyphenyl-8-azapurine-6-one KBio3_001966 5-(2-Propoxy-phenyl)-3,6-dihydro-[1,2,3]triazolo[4,5-d]pyrimidin-7-one SR-01000075536 Tox21_110306_1 Zaprinast, solid M&B-22948 7H-1,2,3-Triazolo(4,5-d)pyrimidin-7-one, 1,4-dihydro-5-(2-propoxyphenyl)- NCGC00016105-02 AOB5951 NCGC00024894-08 BRD-K16542329-001-08-5 Prestwick0_000335 CCG-222544 SCHEMBL6913739 DivK1c_000584 Spectrum4_001032 GTPL2919 1,4-Dihydro-5-(2-propoxyphenyl)-1,2,3-triazolo(4,5-d)pyrimidin-7-one HMS2235N23 2-(2-propoxyphenyl)-8-azahypoxanthine IN1012 3,6-Dihydro-5-(2-propoxyphenyl)-7H-(1,2,3)truaziki(4,5-d)pyrimidin-7-on Lopac-Z-0878 5-(2-propoxyphenyl)-2,3-dihydrotriazolo[4,5-d]pyrimidin-7-one SR-01000075536-5 Z 0878 ZINC14953365 [ Show all ]
Inchi Key	REZGGXNDEMKIQB-UHFFFAOYSA-N
Inchi ID	InChI=1S/C13H13N5O2/c1-2-7-20-9-6-4-3-5-8(9)11-14-12-10(13(19)15-11)16-18-17-12/h3-6H,2,7H2,1H3,(H2,14,15,16,17,18,19)
PubChem CID	135399235
ChEMBL	CHEMBL28079
IUPHAR	2919
BindingDB	14363
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand satisfies Lipinski's rule of five.

Experimental Data

Parameter	Value	Reference	Database source
EC50	980.0 nM	PMID23713606	BindingDB,ChEMBL

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