Ki Summary

Reaction Details

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Target

Glucocorticoid receptor

Ligand

BDBM50338738

Substrate/Competitor

n/a

Meas. Tech.

ChEMBL_726913 (CHEMBL1686702)

7.6±n/a nM

Citation

Roach, SL; Higuchi, RI; Hudson, AR; Vassar, A; Grant, VH; Lamer, R; Hooper, C; Rungta, D; Syka, PM; Mais, DE; Marschke, KB; Zhi, L Tetrahydroquinolin-3-yl carbamate glucocorticoid receptor agonists with reduced PEPCK activation. Bioorg Med Chem Lett21:1658-62 (2011) [PubMed] Article

More Info.:

Get all data from this article, Assay Method

Glucocorticoid receptor

Name:

Glucocorticoid receptor

Synonyms:

GCR_HUMAN | GR | GRL | Glucocorticoid | Glucocorticoid receptor (GRFP) | NR3C1 | Nuclear receptor subfamily 3 group C member 1

Type:

Enzyme

Mol. Mass.:

85656.87

Organism:

Homo sapiens (Human)

Description:

P04150

Residue:

777

Sequence:

MDSKESLTPGREENPSSVLAQERGDVMDFYKTLRGGATVKVSASSPSLAVASQSDSKQRR
LLVDFPKGSVSNAQQPDLSKAVSLSMGLYMGETETKVMGNDLGFPQQGQISLSSGETDLK
LLEESIANLNRSTSVPENPKSSASTAVSAAPTEKEFPKTHSDVSSEQQHLKGQTGTNGGN
VKLYTTDQSTFDILQDLEFSSGSPGKETNESPWRSDLLIDENCLLSPLAGEDDSFLLEGN
SNEDCKPLILPDTKPKIKDNGDLVLSSPSNVTLPQVKTEKEDFIELCTPGVIKQEKLGTV
YCQASFPGANIIGNKMSAISVHGVSTSGGQMYHYDMNTASLSQQQDQKPIFNVIPPIPVG
SENWNRCQGSGDDNLTSLGTLNFPGRTVFSNGYSSPSMRPDVSSPPSSSSTATTGPPPKL
CLVCSDEASGCHYGVLTCGSCKVFFKRAVEGQHNYLCAGRNDCIIDKIRRKNCPACRYRK
CLQAGMNLEARKTKKKIKGIQQATTGVSQETSENPGNKTIVPATLPQLTPTLVSLLEVIE
PEVLYAGYDSSVPDSTWRIMTTLNMLGGRQVIAAVKWAKAIPGFRNLHLDDQMTLLQYSW
MFLMAFALGWRSYRQSSANLLCFAPDLIINEQRMTLPCMYDQCKHMLYVSSELHRLQVSY
EEYLCMKTLLLLSSVPKDGLKSQELFDEIRMTYIKELGKAIVKREGNSSQNWQRFYQLTK
LLDSMHEVVENLLNYCFQTFLDKTMSIEFPEMLAEIITNQIPKYSNGNIKKLLFHQK

BDBM50338738

n/a

Name

BDBM50338738

Synonyms:

(3R,4S)-6-(3-chloro-1H-indol-7-yl)-5,7-difluoro-2,2,4-trimethyl-1,2,3,4-tetrahydroquinolin-3-yl phenylcarbamate | CHEMBL1684347

Type

Small organic molecule

Emp. Form.

C27H24ClF2N3O2

Mol. Mass.

495.948

SMILES

C[C@@H]1[C@@H](OC(=O)Nc2ccccc2)C(C)(C)Nc2cc(F)c(c(F)c12)-c1cccc2c(Cl)c[nH]c12 |r,wU:2.2,wD:1.0,(1.33,-45.61,;1.33,-47.15,;2.67,-47.93,;4.01,-47.16,;5.34,-47.94,;5.34,-49.48,;6.68,-47.17,;8.01,-47.94,;8,-49.48,;9.33,-50.26,;10.67,-49.49,;10.67,-47.94,;9.34,-47.18,;2.67,-49.48,;4.21,-49.47,;2.66,-51.01,;1.33,-50.24,;-0,-49.47,;-1.33,-50.25,;-2.66,-49.48,;-4,-50.25,;-2.66,-47.93,;-1.33,-47.16,;-1.34,-45.62,;0,-47.93,;-4,-47.16,;-3.99,-45.62,;-5.32,-44.85,;-6.66,-45.62,;-6.65,-47.18,;-7.78,-48.22,;-9.29,-47.91,;-7.14,-49.61,;-5.62,-49.43,;-5.32,-47.93,)|

Structure