Ki Summary

Reaction Details

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Target

Glucocorticoid receptor

Ligand

BDBM50338728

Substrate/Competitor

n/a

Meas. Tech.

ChEMBL_726913 (CHEMBL1686702)

5.1±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

BDBM50338728

n/a

Name

BDBM50338728

Synonyms:

(3R,4S)-5,7-difluoro-6-(1H-indol-7-yl)-2,2,4-trimethyl-1,2,3,4-tetrahydroquinolin-3-yl 4-(dimethylamino)phenylcarbamate | CHEMBL1684356

Type

Small organic molecule

Emp. Form.

C29H30F2N4O2

Mol. Mass.

504.5709

SMILES

C[C@@H]1[C@@H](OC(=O)Nc2ccc(cc2)N(C)C)C(C)(C)Nc2cc(F)c(c(F)c12)-c1cccc2cc[nH]c12 |r,wU:2.2,wD:1.0,(23.84,-25.58,;23.84,-27.12,;25.18,-27.9,;26.52,-27.14,;27.85,-27.91,;27.85,-29.45,;29.19,-27.14,;30.52,-27.92,;30.51,-29.46,;31.84,-30.23,;33.18,-29.46,;33.18,-27.91,;31.85,-27.15,;34.51,-30.23,;34.51,-31.77,;35.85,-29.47,;25.18,-29.45,;26.72,-29.45,;25.17,-30.99,;23.84,-30.22,;22.51,-29.45,;21.18,-30.22,;19.84,-29.45,;18.51,-30.22,;19.85,-27.91,;21.18,-27.14,;21.17,-25.6,;22.51,-27.9,;18.51,-27.14,;18.52,-25.6,;17.19,-24.83,;15.85,-25.6,;15.86,-27.15,;14.73,-28.19,;15.36,-29.58,;16.89,-29.41,;17.19,-27.91,)|

Structure