Zhang Lab

University of Michigan

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

GLASS

You can:

Check the ligand table for details.
Go to the GPCR list to see GPCRs with which this ligand interacts.
Go to the individual GPCR page for PubMed ID information by text mining.
Download a TSV version of all interaction data.
Go back to previous page.

Ligand

Name	5-Bromotryptamine
Molecular formula	C10H11BrN2
IUPAC name	2-(5-bromo-1H-indol-3-yl)ethanamine
Molecular weight	239.116
Hydrogen bond acceptor	1
Hydrogen bond donor	2
XlogP	1.3
Synonyms	2-(5-BROMO-1H-INDOL-3-YL)ETHAN-1-AMINE BP-13334 KB-244764 3610-42-2 AC1Q25YL CHEMBL1288717 SCHEMBL1520598 1H-Indole-3-ethanamine,5-bromo- 5-bromo-tryptamine AKOS005207534 F2113-0573 2-(5-bromo-1H-indol-3-yl)ethanamine AB03690 CGHUQJRRADEHTQ-UHFFFAOYSA-N MFCD00130169 1613AE 5-Br-T ACN-049131 CTK4H5898 ZINC403685 2-(5-BROMO-1H-INDOL-3-YL)-ETHYLAMINE BDBM50331288 K-8096 3-(2-Aminoethyl)-5-bromoindole AC1L2SH6 Oprea1_552997 1H-INDOLE-3-ETHANAMINE, 5-BROMO- 5-Bromo-1H-indole-3-ethylamine AJ-22171 EINECS 222-779-8 [ Show all ]
Inchi Key	CGHUQJRRADEHTQ-UHFFFAOYSA-N
Inchi ID	InChI=1S/C10H11BrN2/c11-8-1-2-10-9(5-8)7(3-4-12)6-13-10/h1-2,5-6,13H,3-4,12H2
PubChem CID	77158
ChEMBL	CHEMBL1288717
IUPHAR	N/A
BindingDB	50331288
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand satisfies Lipinski's rule of five.

Known GPCRs

You can:

Click GLASS IDs to check the association information.
Click protein names to check details of the GPCRs.
Download a TSV version of all interaction information.

GLASS ID	Name	UniProt	Gene	Species	Length
443317	5-hydroxytryptamine receptor 2A	P28223	HTR2A	Homo sapiens (Human)	471
555633	5-hydroxytryptamine receptor 2A	P14842	Htr2a	Rattus norvegicus (Rat)	471
41324	5-hydroxytryptamine receptor 2B	P41595	HTR2B	Homo sapiens (Human)	481
41326	5-hydroxytryptamine receptor 2B	P30994	Htr2b	Rattus norvegicus (Rat)	479
41325	5-hydroxytryptamine receptor 2C	P28335	HTR2C	Homo sapiens (Human)	458

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