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BDBM346975 US10202379, Reference Example 710

SMILES: CC(O)c1cn2N(CN([C@H](C)C(F)(F)F)C(=O)c2c(O)c1=O)[C@@H]1c2ccccc2SCc2cccc(Cl)c12

InChI Key: InChIKey=JYEYWCHTHQTCOB-SGTNWVKBSA-N

Data: 1 IC50  1 EC50

Find this compound or compounds like it in BindingDB or PDB:
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Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 346975   
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
Transcription initiation factor TFIID subunit 1


(Homo sapiens (Human))
BDBM346975
PNG
(US10202379, Reference Example 710)
Show SMILES CC(O)c1cn2N(CN([C@H](C)C(F)(F)F)C(=O)c2c(O)c1=O)[C@@H]1c2ccccc2SCc2cccc(Cl)c12 |r,w:1.1|
Show InChI InChI=1S/C26H23ClF3N3O4S/c1-13(34)17-10-32-22(24(36)23(17)35)25(37)31(14(2)26(28,29)30)12-33(32)21-16-7-3-4-9-19(16)38-11-15-6-5-8-18(27)20(15)21/h3-10,13-14,21,34,36H,11-12H2,1-2H3/t13?,14-,21-/m1/s1
PDB

KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/an/an/a 9.81n/an/an/an/a



SHIONOGI & CO., LTD.

US Patent


Assay Description
A test sample was diluted with a culture medium to an appropriate concentration in advance, and then 2 to 5-fold serial dilution on a 96 well plate (...


US Patent US10202379 (2019)


BindingDB Entry DOI: 10.7270/Q2XK8HP2
More data for this
Ligand-Target Pair
Transcription initiation factor TFIID subunit 1


(Homo sapiens (Human))
BDBM346975
PNG
(US10202379, Reference Example 710)
Show SMILES CC(O)c1cn2N(CN([C@H](C)C(F)(F)F)C(=O)c2c(O)c1=O)[C@@H]1c2ccccc2SCc2cccc(Cl)c12 |r,w:1.1|
Show InChI InChI=1S/C26H23ClF3N3O4S/c1-13(34)17-10-32-22(24(36)23(17)35)25(37)31(14(2)26(28,29)30)12-33(32)21-16-7-3-4-9-19(16)38-11-15-6-5-8-18(27)20(15)21/h3-10,13-14,21,34,36H,11-12H2,1-2H3/t13?,14-,21-/m1/s1
PDB

KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 20.6n/an/an/an/an/an/a



SHIONOGI & CO., LTD.

US Patent


Assay Description
A test sample was diluted with a culture medium to an appropriate concentration in advance, and then 2 to 5-fold serial dilution on a 96 well plate (...


US Patent US10202379 (2019)


BindingDB Entry DOI: 10.7270/Q2XK8HP2
More data for this
Ligand-Target Pair