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 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

Namenetazepide
Molecular formulaC28H30N6O3
IUPAC name1-[(3R)-1-(3,3-dimethyl-2-oxobutyl)-2-oxo-5-pyridin-2-yl-3H-1,4-benzodiazepin-3-yl]-3-[3-(methylamino)phenyl]urea
Molecular weight498.587
Hydrogen bond acceptor6
Hydrogen bond donor3
XlogP3.8
SynonymsHOU4I0G29C
Sograzepide
ZINC3810905
CHEMBL324547
YDZYKNJZCVIKPP-VWLOTQADSA-N
[ Show all ]
Inchi KeyYDZYKNJZCVIKPP-VWLOTQADSA-N
Inchi IDInChI=1S/C28H30N6O3/c1-28(2,3)23(35)17-34-22-14-6-5-12-20(22)24(21-13-7-8-15-30-21)32-25(26(34)36)33-27(37)31-19-11-9-10-18(16-19)29-4/h5-16,25,29H,17H2,1-4H3,(H2,31,33,37)/t25-/m0/s1
PubChem CID9870520
ChEMBLCHEMBL324547
IUPHAR887
BindingDB50056102
DrugBankN/A

Structure

SDF download

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

Known GPCRs

You can:

Total entries: 6
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
407832Cholecystokinin receptor type AP30551CckarRattus norvegicus (Rat)444
407833Cholecystokinin receptor type AP32238CCKARHomo sapiens (Human)428
407837Cholecystokinin receptor type AQ63931CCKARCavia porcellus (Guinea pig)430
407834Gastrin/cholecystokinin type B receptorP30553CckbrRattus norvegicus (Rat)452
407835Gastrin/cholecystokinin type B receptorP32239CCKBRHomo sapiens (Human)447
407836Gastrin/cholecystokinin type B receptorP30552CCKBRCanis lupus familiaris (Dog)453

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