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BDBM243334 US10053454, Example 78::US10196387, Example 78

SMILES: Cc1noc(C)c1-c1cc(C(N)=O)c2n(CC3CC3)c3ccc(cc3c2c1)S(C)(=O)=O

InChI Key: InChIKey=LCEJWNKDKMSXGH-UHFFFAOYSA-N

Data: 3 IC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 243334   
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
Bromodomain-containing protein 4


(Homo sapiens (Human))
BDBM243334
PNG
(US10053454, Example 78 | US10196387, Example 78)
Show SMILES Cc1noc(C)c1-c1cc(C(N)=O)c2n(CC3CC3)c3ccc(cc3c2c1)S(C)(=O)=O
Show InChI InChI=1S/C23H23N3O4S/c1-12-21(13(2)30-25-12)15-8-18-17-10-16(31(3,28)29)6-7-20(17)26(11-14-4-5-14)22(18)19(9-15)23(24)27/h6-10,14H,4-5,11H2,1-3H3,(H2,24,27)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a<50n/an/an/an/an/an/a



Bristol-Myers Squibb Company

US Patent


Assay Description
The binding of compounds to bromodomain BRD4 (44-168), BRD4 (333-460), and BRD4 (1-477 or 44-460) was assessed using a time resolved fluorescent reso...


US Patent US10053454 (2018)


BindingDB Entry DOI: 10.7270/Q2C24ZFN
More data for this
Ligand-Target Pair
Bromodomain-containing protein 4


(Homo sapiens (Human))
BDBM243334
PNG
(US10053454, Example 78 | US10196387, Example 78)
Show SMILES Cc1noc(C)c1-c1cc(C(N)=O)c2n(CC3CC3)c3ccc(cc3c2c1)S(C)(=O)=O
Show InChI InChI=1S/C23H23N3O4S/c1-12-21(13(2)30-25-12)15-8-18-17-10-16(31(3,28)29)6-7-20(17)26(11-14-4-5-14)22(18)19(9-15)23(24)27/h6-10,14H,4-5,11H2,1-3H3,(H2,24,27)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a<50n/an/an/an/an/an/a



Bristol-Myers Squibb Company

US Patent


Assay Description
The binding of compounds to bromodomain BRD4 (44-168), BRD4 (333-460), and BRD4 (1-477 or 44-460) was assessed using a time resolved fluorescent reso...


US Patent US10196387 (2019)


BindingDB Entry DOI: 10.7270/Q29S1T30
More data for this
Ligand-Target Pair
Bromodomain-containing protein 4


(Homo sapiens (Human))
BDBM243334
PNG
(US10053454, Example 78 | US10196387, Example 78)
Show SMILES Cc1noc(C)c1-c1cc(C(N)=O)c2n(CC3CC3)c3ccc(cc3c2c1)S(C)(=O)=O
Show InChI InChI=1S/C23H23N3O4S/c1-12-21(13(2)30-25-12)15-8-18-17-10-16(31(3,28)29)6-7-20(17)26(11-14-4-5-14)22(18)19(9-15)23(24)27/h6-10,14H,4-5,11H2,1-3H3,(H2,24,27)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a<50n/an/an/an/an/an/a



Bristol-Myers Squibb Company

US Patent


Assay Description
The binding of compounds to bromodomain BRD4 (44-168), BRD4 (333-460), and BRD4 (1-477 or 44-460) was assessed using a time resolved fluorescent reso...


US Patent US10196387 (2019)


BindingDB Entry DOI: 10.7270/Q26112DD
More data for this
Ligand-Target Pair