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BDBM299273 US9593113, Example 38

SMILES: CCC(C)c1ccc(cc1)-c1ccc2[C@H](c3ccccc3Oc2n1)C(C)(C)C(=O)NC(N)=O

InChI Key: InChIKey=DUWRTTMXHIKPGQ-XXFTZOLFNA-N

Data: 1 KI

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 299273   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Glucocorticoid receptor


(Homo sapiens (Human))
BDBM299273
PNG
(US9593113, Example 38)
Show SMILES CCC(C)c1ccc(cc1)-c1ccc2[C@H](c3ccccc3Oc2n1)C(C)(C)C(=O)NC(N)=O
Show InChI InChI=1/C27H29N3O3/c1-5-16(2)17-10-12-18(13-11-17)21-15-14-20-23(27(3,4)25(31)30-26(28)32)19-8-6-7-9-22(19)33-24(20)29-21/h6-16,23H,5H2,1-4H3,(H3,28,30,31,32)/t16?,23-/s2
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
PC cid
PC sid
UniChem
Article
US Patent
1.74n/an/an/an/an/an/an/an/a



Bristol-Myers Squibb Co.

US Patent


Assay Description
Binding Assay (I):In order to assess the affinity of test compounds for the human glucocorticoid receptor, a commercially available kit was used (Glu...


US Patent US9593113 (2017)


Article DOI: 10.1021/jm020319p
BindingDB Entry DOI: 10.7270/Q2833V3Z
More data for this
Ligand-Target Pair