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

I-TASSER I-TASSER-MTD C-I-TASSER CR-I-TASSER QUARK C-QUARK LOMETS MUSTER CEthreader SEGMER DeepFold DeepFoldRNA FoldDesign COFACTOR COACH MetaGO TripletGO IonCom FG-MD ModRefiner REMO DEMO DEMO-EM DMFold SPRING COTH Threpp PEPPI BSpred ANGLOR EDock BSP-SLIM SAXSTER FUpred ThreaDom ThreaDomEx EvoDesign BindProf BindProfX SSIPe GPCR-I-TASSER MAGELLAN ResQ STRUM DAMpred

TM-score TM-align US-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 TripletRes DeepPotential WDL-RF ATPbind DockRMSD DeepMSA FASPR EM-Refiner GPU-I-TASSER

BioLiP E. coli GLASS GPCR-HGmod GPCR-RD GPCR-EXP Tara-3D TM-fold DECOYS POTENTIAL RW/RWplus EvoEF HPSF THE-DB ADDRESS Alpaca-Antibody CASP7 CASP8 CASP9 CASP10 CASP11 CASP12 CASP13 CASP14

You can:

Ligand

Nameindomethacin
Molecular formulaC19H16ClNO4
IUPAC name2-[1-(4-chlorobenzoyl)-5-methoxy-2-methylindol-3-yl]acetic acid
Molecular weight357.79
Hydrogen bond acceptor4
Hydrogen bond donor1
XlogP4.3
SynonymsCTK3J2195
LS-187
2-[1-(4-chlorobenzoyl)-5-methoxy-2-methylindol-3-yl]acetic acid
Indometacin [INN]
Dolovin
[ Show all ]
Inchi KeyCGIGDMFJXJATDK-UHFFFAOYSA-N
Inchi IDInChI=1S/C19H16ClNO4/c1-11-15(10-18(22)23)16-9-14(25-2)7-8-17(16)21(11)19(24)12-3-5-13(20)6-4-12/h3-9H,10H2,1-2H3,(H,22,23)
PubChem CID3715
ChEMBLCHEMBL6
IUPHAR1909
BindingDB17638
DrugBankDB00328

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand satisfies Lipinski's rule of five.

Known GPCRs

You can:

Total entries: 13
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
41355Cannabinoid receptor 1P21554CNR1Homo sapiens (Human)472
41350Cannabinoid receptor 2P34972CNR2Homo sapiens (Human)360
41356Neuropeptide S receptorQ6W5P4NPSR1Homo sapiens (Human)371
41348Prostaglandin D2 receptorP70263PtgdrMus musculus (Mouse)357
41349Prostaglandin D2 receptor 2Q9Y5Y4PTGDR2Homo sapiens (Human)395
553448Prostaglandin D2 receptor 2Q9Z2J6Ptgdr2Mus musculus (Mouse)382
41351Prostaglandin E2 receptor EP1 subtypeP35375Ptger1Mus musculus (Mouse)405
41347Prostaglandin E2 receptor EP2 subtypeP43116PTGER2Homo sapiens (Human)358
41352Prostaglandin E2 receptor EP2 subtypeQ62053Ptger2Mus musculus (Mouse)362
41354Prostaglandin E2 receptor EP2 subtypeQ9XT82PTGER2Canis lupus familiaris (Dog)361
41358Prostaglandin E2 receptor EP3 subtypeP30557Ptger3Mus musculus (Mouse)365
555634Prostaglandin E2 receptor EP3 subtypeP34980Ptger3Rattus norvegicus (Rat)365
41357Prostaglandin E2 receptor EP4 subtypeP32240Ptger4Mus musculus (Mouse)513

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