Zhang Lab

University of Michigan

Home Research COVID-19 Publications People Teaching Job Opening News Forum Lab Only

Online Services

●I-TASSER ●QUARK ●LOMETS ●COACH ●COFACTOR ●MetaGO ●MUSTER ●CEthreader ●SEGMER ●FG-MD ●ModRefiner ●REMO ●DEMO ●SPRING ●COTH ●BSpred ●ANGLOR ●BSP-SLIM ●SAXSTER ●ThreaDom ●ThreaDomEx ●EvoDesign ●GPCR-I-TASSER ●BindProf ●BindProfX ●SSIPe ●ResQ ●IonCom ●STRUM ●DAMpred

●TM-score ●TM-align ●MM-align ●RNA-align ●NW-align ●LS-align ●EDTSurf ●MVP ●MVP-Fit ●SPICKER ●HAAD ●PSSpred ●3DRobot ●MR-REX ●I-TASSER-MR ●SVMSEQ ●NeBcon ●ResPRE ●WDL-RF ●ATPbind ●DockRMSD ●DeepMSA ●FASPR

●BioLiP ●E. coli ●GLASS ●GPCR-HGmod ●GPCR-RD ●GPCR-EXP ●Tara-3D ●TM-fold ●DECOYS ●POTENTIAL ●RW/RWplus ●EvoEF ●HPSF ●THE-DB ●CASP7 ●CASP8 ●CASP9 ●CASP10 ●CASP11 ●CASP12 ●CASP13

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.
Go back to previous page.

GPCR

Name	Hydroxycarboxylic acid receptor 2
Species	Homo sapiens (Human)
Gene	HCAR2
Synonym	G-protein coupled receptor HM74A G-protein coupled receptor 109A PUMAG Nicotinic acid receptor HCA2 receptor Nic1 Niacin receptor 1 Niacr1 G protein-coupled receptor 109A [ Show all ]
Disease	Hyperlipidaemia Acute ischemic stroke Arteriosclerosis Atherosclerosis Cardiovascular disorder Major depressive disorder Type 2 diabetes [ Show all ]
Length	363
Amino acid sequence	MNRHHLQDHFLEIDKKNCCVFRDDFIVKVLPPVLGLEFIFGLLGNGLALWIFCFHLKSWKSSRIFLFNLAVADFLLIICLPFLMDNYVRRWDWKFGDIPCRLMLFMLAMNRQGSIIFLTVVAVDRYFRVVHPHHALNKISNRTAAIISCLLWGITIGLTVHLLKKKMPIQNGGANLCSSFSICHTFQWHEAMFLLEFFLPLGIILFCSARIIWSLRQRQMDRHAKIKRAITFIMVVAIVFVICFLPSVVVRIRIFWLLHTSGTQNCEVYRSVDLAFFITLSFTYMNSMLDPVVYYFSSPSFPNFFSTLINRCLQRKMTGEPDNNRSTSVELTGDPNKTRGAPEALMANSGEPWSPSYLGPTSP
UniProt	Q8TDS4
Protein Data Bank	N/A
GPCR-HGmod model	Q8TDS4
3D structure model	This predicted structure model is from GPCR-EXP Q8TDS4.
BioLiP	N/A
Therapeutic Target Database	T00864
ChEMBL	CHEMBL3785
IUPHAR	312
DrugBank	BE0000635

Ligand

Name	4-Methoxycinnamic acid
Molecular formula	C10H10O3
IUPAC name	(E)-3-(4-methoxyphenyl)prop-2-enoic acid
Molecular weight	178.187
Hydrogen bond acceptor	3
Hydrogen bond donor	1
XlogP	1.8
Synonyms	830-09-1 P-METHOXYCINNAMIC ACID 3-(4-methoxyphenyl)acrylic acid 943-89-5 trans-4-Methoxycinnamic acid 4-Methoxycinnamate para-methoxycinnamic acid O-Methyl-p-coumaric acid Cinnamic acid, p-methoxy- (E)-3-(4-Methoxyphenyl)acrylic acid (E)-4-METHOXYCINNAMIC ACID 3-(4-Methoxyphenyl)-2-propenoic acid Cinnamic acid, 4-methoxy- 2-Propenoic acid, 3-(4-methoxyphenyl)- 2-Propenoic acid, 3-(4-methoxyphenyl)-, (2E)- (E)-3-(4-methoxyphenyl)-2-propenoic acid (2E)-3-(4-methoxyphenyl)prop-2-enoic acid METHOXYCINNAMIC ACID, PARA p-methoxycinnamate (E)-3-(4-methoxyphenyl)prop-2-enoic acid UNII-6G4ML8401A PMCA NSC 5303 P-Methoxy ciannamic acid EINECS 212-594-0 3-(4-methoxyphenyl)prop-2-enoic acid trans-3-(4-Methoxyphenyl)acrylic acid CHEMBL95770 AI3-23399 4-Methoxy-(2E)-cinnamic acid (2E)-3-(4-METHOXYPHENYL)ACRYLIC ACID AFDXODALSZRGIH-QPJJXVBHSA-N trans-2-Propenoic acid, 3-(4-methoxyphenyl)- 6G4ML8401A NSC-5303 MFCD00004398 NSC-623437 NCGC00159448-02 (E)-3-(4-Methoxy-phenyl)-acrylic acid 4-Methoxy cinnamic acid p-Methoxycinnamic acid, 99%, predominantly trans (E)-p-Methoxycinnamic acid Bernel hydro 3-(4-Methoxy-phenyl)-acrylic acid EINECS 213-405-4 para-methoxycinnamate 4-Methoxy cinnamate P-Methoxy ciannamate O-Methyl-p-coumarate PubChem8248 p-MCA p-methoxy-cinnamic acid trans-4-Methoxycinnamate AC1LF8QH AC1Q5RAR O-Methyl-p-cumaric Acid bmse010212 4-Methoxybenzeneacrylic acid DSSTox_CID_26059 DSSTox_RID_81310 2-Propenoic acid, 3-(4-methoxyphenyl)-, (E)- AKOS BBB/225 DSSTox_GSID_46059 SCHEMBL58699 (E)-p-Methoxy-cinnamic acid MLS002473129 trans-4-methoxy-cinnamic acid RARECHEM BK HC T257 ARONIS000351 METHOXYCINNAMIC ACID,4- 3-(4-Methoxy-phenyl)-acrylate DTXSID1046059 AFDXODALSZRGIH-QPJJXVBHSA- CHEBI:48541 TIMTEC-BB SBB005717 ZINC77999 NSC5303 AKOS B000181 MolPort-000-655-960 ART-CHEM-BB B000181 HMS1783A08 HMS2267B19 (E)-3-(4-Methoxyphenyl)acrylate 3-(4-methoxyphenyl)-2-Propenoate ALBB-011726 BCP21420 HY-N1387 7340-42-3 (hydrochloride salt) AKOS BBS-00000769 Tox21_111674 AKOS A1230-2778 BBL012085 BDBM50146453 LABOTEST-BB LT00108121 LABOTEST-BB LT03333631 NSC623437 SBB005717 STK005095 AKOS000118882 AS01561 EBD2197791 LS11390 MCULE-6993960877 MP-2212 PS-5777 RP17443 RTR-025896 RTR-029508 (E)-3-(4-methoxyphenyl)-acrylic acid OTAVA-BB 0123400502 NCGC00159448-03 NCGC00159448-04 30-09-1 AC-10371 AJ-10423 AK-98686 AN-20523 CAS-943-89-5 KB-72675 SC-50019 SC-77648 SMR000112200 ST098720 4-Methoxycinnamic acid, >=98.0% (GC) p-Methoxycinnamic acid, predominantly trans 4-Methoxycinnamic acid, predominantly trans AB1003581 LS-123672 ST2410363 TR-029508 TR-049560 CS-0016807 M0576 AZ0001-0155 (2E)-3-(4-Methoxyphenyl)-2-propenoic acid # 4-Methoxycinnamic acid, predominantly trans, 99% 830M091 A837404 AE-641/00135031 I04-9543 W-100196 W-104154 F1638-0067 0C546A89-9721-4B4E-89EE-7EC28A9A3391 InChI=1/C10H10O3/c1-13-9-5-2-8(3-6-9)4-7-10(11)12/h2-7H,1H3,(H,11,12)/b7-4+ [ Show all ]
Inchi Key	AFDXODALSZRGIH-QPJJXVBHSA-N
Inchi ID	InChI=1S/C10H10O3/c1-13-9-5-2-8(3-6-9)4-7-10(11)12/h2-7H,1H3,(H,11,12)/b7-4+
PubChem CID	699414
ChEMBL	CHEMBL95770
IUPHAR	N/A
BindingDB	N/A
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand satisfies Lipinski's rule of five.

Experimental Data

Parameter	Value	Reference	Database source
Activity	0.0 %	PMID21167710	ChEMBL

yangzhanglabumich.edu | (734) 647-1549 | 100 Washtenaw Avenue, Ann Arbor, MI 48109-2218