Found 3 hits Enz. Inhib. hit(s) with Target = 'Bromodomain-containing protein 4 [342-460]' and Ligand = 'BDBM362504' Target/Host
(Institution) | Ligand | Target/Host
Links | Ligand
Links | Trg + Lig
Links | Ki
nM | ΔG°
kJ/mole | IC50
nM | Kd
nM | EC50/IC50
nM | koff
s-1 | kon
M-1s-1 | pH | Temp
°C |
|---|
Bromodomain-containing protein 4 [342-460]
(Homo sapiens (Human)) | BDBM362504
((4S)-2-[(2R,6S)-4-Acetyl-2,6-dimethylpiperazin-1-y...)Show SMILES C[C@H]1CN(C[C@@H](C)N1c1nc2ccc(-c3c(C)noc3C)c3OC[C@H](c4ccccn4)n1c23)C(C)=O |r,wU:1.0,5.5,wD:24.26,(.73,1.56,;2.21,1.16,;3.3,2.25,;4.79,1.85,;5.19,.36,;4.1,-.73,;4.5,-2.22,;2.61,-.33,;1.52,-1.42,;1.12,-2.91,;-.41,-2.99,;-1.38,-4.18,;-2.9,-3.94,;-3.46,-2.51,;-5,-2.51,;-5.9,-3.75,;-5.13,-5.09,;-7.37,-3.28,;-7.37,-1.74,;-5.9,-1.26,;-5.13,.07,;-2.49,-1.31,;-3.04,.13,;-2.07,1.33,;-.55,1.08,;.22,2.42,;1.76,2.42,;2.53,3.75,;1.76,5.09,;.22,5.09,;-.55,3.75,;.23,-.58,;-.97,-1.55,;5.88,2.94,;5.48,4.42,;7.37,2.54,)| Show InChI InChI=1S/C27H30N6O3/c1-15-12-31(19(5)34)13-16(2)32(15)27-29-22-10-9-20(24-17(3)30-36-18(24)4)26-25(22)33(27)23(14-35-26)21-8-6-7-11-28-21/h6-11,15-16,23H,12-14H2,1-5H3/t15-,16+,23-/m1/s1 | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet 
| PC cid
PC sid
UniChem
| US Patent
| n/a | n/a | <25 | n/a | n/a | n/a | n/a | n/a | n/a |
Incyte Corporation
US Patent
| Assay Description
BRD4-BD1 and BRD4-BD2 assays were conducted in white 384-well polystyrene plate in a final volume of 20 μL for BD1 and 40 μL for BD2. Inhib... |
US Patent US9834565 (2017)
BindingDB Entry DOI: 10.7270/Q29P33XS |
More data for this
Ligand-Target Pair | |
Bromodomain-containing protein 4 [342-460]
(Homo sapiens (Human)) | BDBM362504
((4S)-2-[(2R,6S)-4-Acetyl-2,6-dimethylpiperazin-1-y...)Show SMILES C[C@H]1CN(C[C@@H](C)N1c1nc2ccc(-c3c(C)noc3C)c3OC[C@H](c4ccccn4)n1c23)C(C)=O |r,wU:1.0,5.5,wD:24.26,(.73,1.56,;2.21,1.16,;3.3,2.25,;4.79,1.85,;5.19,.36,;4.1,-.73,;4.5,-2.22,;2.61,-.33,;1.52,-1.42,;1.12,-2.91,;-.41,-2.99,;-1.38,-4.18,;-2.9,-3.94,;-3.46,-2.51,;-5,-2.51,;-5.9,-3.75,;-5.13,-5.09,;-7.37,-3.28,;-7.37,-1.74,;-5.9,-1.26,;-5.13,.07,;-2.49,-1.31,;-3.04,.13,;-2.07,1.33,;-.55,1.08,;.22,2.42,;1.76,2.42,;2.53,3.75,;1.76,5.09,;.22,5.09,;-.55,3.75,;.23,-.58,;-.97,-1.55,;5.88,2.94,;5.48,4.42,;7.37,2.54,)| Show InChI InChI=1S/C27H30N6O3/c1-15-12-31(19(5)34)13-16(2)32(15)27-29-22-10-9-20(24-17(3)30-36-18(24)4)26-25(22)33(27)23(14-35-26)21-8-6-7-11-28-21/h6-11,15-16,23H,12-14H2,1-5H3/t15-,16+,23-/m1/s1 | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| US Patent
| n/a | n/a | <25 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
| Assay Description
BRD4-BD1 and BRD4-BD2 assays were conducted in white 384-well polystyrene plate in a final volume of 20 μL for BD1 and 40 μL for BD2. Inhib... |
J Med Chem 51: 1904-12 (2008)
BindingDB Entry DOI: 10.7270/Q2D50Q7W |
More data for this
Ligand-Target Pair | |
Bromodomain-containing protein 4 [342-460]
(Homo sapiens (Human)) | BDBM362504
((4S)-2-[(2R,6S)-4-Acetyl-2,6-dimethylpiperazin-1-y...)Show SMILES C[C@H]1CN(C[C@@H](C)N1c1nc2ccc(-c3c(C)noc3C)c3OC[C@H](c4ccccn4)n1c23)C(C)=O |r,wU:1.0,5.5,wD:24.26,(.73,1.56,;2.21,1.16,;3.3,2.25,;4.79,1.85,;5.19,.36,;4.1,-.73,;4.5,-2.22,;2.61,-.33,;1.52,-1.42,;1.12,-2.91,;-.41,-2.99,;-1.38,-4.18,;-2.9,-3.94,;-3.46,-2.51,;-5,-2.51,;-5.9,-3.75,;-5.13,-5.09,;-7.37,-3.28,;-7.37,-1.74,;-5.9,-1.26,;-5.13,.07,;-2.49,-1.31,;-3.04,.13,;-2.07,1.33,;-.55,1.08,;.22,2.42,;1.76,2.42,;2.53,3.75,;1.76,5.09,;.22,5.09,;-.55,3.75,;.23,-.58,;-.97,-1.55,;5.88,2.94,;5.48,4.42,;7.37,2.54,)| Show InChI InChI=1S/C27H30N6O3/c1-15-12-31(19(5)34)13-16(2)32(15)27-29-22-10-9-20(24-17(3)30-36-18(24)4)26-25(22)33(27)23(14-35-26)21-8-6-7-11-28-21/h6-11,15-16,23H,12-14H2,1-5H3/t15-,16+,23-/m1/s1 | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| US Patent
| n/a | n/a | <25 | n/a | n/a | n/a | n/a | n/a | n/a |
Incyte Corporation
US Patent
| Assay Description
BRD4-BD1 and BRD4-BD2 assays were conducted in white 384-well polystyrene plate in a final volume of 20 μL for BD1 and 40 μL for BD2. Inhib... |
US Patent US10618910 (2020)
BindingDB Entry DOI: 10.7270/Q2XD14QK |
More data for this
Ligand-Target Pair | |
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