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Target
Sequence
Name
&
Ki
IC50
Kd
EC50
Rate constants
ΔG°
ΔH°
-TΔS°
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Ki
IC50
Kd
EC50
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-TΔS°
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Compile Data Set for Download or QSAR
Found
10
hits of ki for monomerid = 50098311
Target/Host
(Institution)
Ligand
Target/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
k
off
s
-1
k
on
M
-1
s
-1
pH
Temp
°C
ATPase family AAA domain-containing protein 2
(Homo sapiens (Human))
BDBM50098311
(CHEMBL3590408)
Show SMILES
CN1CC[C@@H](Nc2ncc(-c3cncc(C)c3)c3cc(C)c(=O)[nH]c23)[C@@H](C1)OCC1CCS(=O)(=O)CC1 |r|
Show InChI
PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
CHEMBL
PC cid
PC sid
UniChem
Similars
Article
PubMed
20
n/a
n/a
n/a
n/a
n/a
n/a
n/a
n/a
GlaxoSmithKline
Curated by
ChEMBL
Assay Description
Binding affinity to ATAD2 (unknown origin) by BROMOscan panel based assay
J Med Chem
58:
6151
-
78
(2015)
Article DOI:
10.1021/acs.jmedchem.5b00773
BindingDB Entry DOI:
10.7270/Q2FN17Z1
More data for this
Ligand-Target Pair
ATPase family AAA domain-containing protein 2
(Homo sapiens (Human))
BDBM50098311
(CHEMBL3590408)
Show SMILES
CN1CC[C@@H](Nc2ncc(-c3cncc(C)c3)c3cc(C)c(=O)[nH]c23)[C@@H](C1)OCC1CCS(=O)(=O)CC1 |r|
Show InChI
PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
CHEMBL
PC cid
PC sid
UniChem
Similars
Article
PubMed
20
n/a
n/a
n/a
n/a
n/a
n/a
n/a
n/a
GlaxoSmithKline
Curated by
ChEMBL
Assay Description
Binding affinity to ATAD2 (unknown origin) by BROMOscan panel based assay
J Med Chem
58:
6151
-
78
(2015)
Article DOI:
10.1021/acs.jmedchem.5b00773
BindingDB Entry DOI:
10.7270/Q2FN17Z1
More data for this
Ligand-Target Pair
ATPase family AAA domain-containing protein 2B
(Homo sapiens (Human))
BDBM50098311
(CHEMBL3590408)
Show SMILES
CN1CC[C@@H](Nc2ncc(-c3cncc(C)c3)c3cc(C)c(=O)[nH]c23)[C@@H](C1)OCC1CCS(=O)(=O)CC1 |r|
Show InChI
PDB
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
CHEMBL
PC cid
PC sid
UniChem
Similars
Article
PubMed
40
n/a
n/a
n/a
n/a
n/a
n/a
n/a
n/a
GlaxoSmithKline
Curated by
ChEMBL
Assay Description
Binding affinity to ATAD2B (unknown origin) by BROMOscan panel based assay
J Med Chem
58:
6151
-
78
(2015)
Article DOI:
10.1021/acs.jmedchem.5b00773
BindingDB Entry DOI:
10.7270/Q2FN17Z1
More data for this
Ligand-Target Pair
Transcription initiation factor TFIID subunit 1
(Homo sapiens (Human))
BDBM50098311
(CHEMBL3590408)
Show SMILES
CN1CC[C@@H](Nc2ncc(-c3cncc(C)c3)c3cc(C)c(=O)[nH]c23)[C@@H](C1)OCC1CCS(=O)(=O)CC1 |r|
Show InChI
PDB
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
CHEMBL
PC cid
PC sid
UniChem
Similars
Article
PubMed
50
n/a
n/a
n/a
n/a
n/a
n/a
n/a
n/a
GlaxoSmithKline
Curated by
ChEMBL
Assay Description
Binding affinity to TAF1 (unknown origin) by BROMOscan panel based assay
J Med Chem
58:
6151
-
78
(2015)
Article DOI:
10.1021/acs.jmedchem.5b00773
BindingDB Entry DOI:
10.7270/Q2FN17Z1
More data for this
Ligand-Target Pair
Transcription initiation factor TFIID subunit 1-like
(Homo sapiens (Human))
BDBM50098311
(CHEMBL3590408)
Show SMILES
CN1CC[C@@H](Nc2ncc(-c3cncc(C)c3)c3cc(C)c(=O)[nH]c23)[C@@H](C1)OCC1CCS(=O)(=O)CC1 |r|
Show InChI
PDB
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
CHEMBL
PC cid
PC sid
UniChem
Similars
Article
PubMed
126
n/a
n/a
n/a
n/a
n/a
n/a
n/a
n/a
GlaxoSmithKline
Curated by
ChEMBL
Assay Description
Binding affinity to TAF1L (unknown origin) by BROMOscan panel based assay
J Med Chem
58:
6151
-
78
(2015)
Article DOI:
10.1021/acs.jmedchem.5b00773
BindingDB Entry DOI:
10.7270/Q2FN17Z1
More data for this
Ligand-Target Pair
Bromodomain-containing protein 1
(Homo sapiens (Human))
BDBM50098311
(CHEMBL3590408)
Show SMILES
CN1CC[C@@H](Nc2ncc(-c3cncc(C)c3)c3cc(C)c(=O)[nH]c23)[C@@H](C1)OCC1CCS(=O)(=O)CC1 |r|
Show InChI
PDB
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
CHEMBL
PC cid
PC sid
UniChem
Similars
Article
PubMed
398
n/a
n/a
n/a
n/a
n/a
n/a
n/a
n/a
GlaxoSmithKline
Curated by
ChEMBL
Assay Description
Binding affinity to BRPF2 (unknown origin) by BROMOscan panel based assay
J Med Chem
58:
6151
-
78
(2015)
Article DOI:
10.1021/acs.jmedchem.5b00773
BindingDB Entry DOI:
10.7270/Q2FN17Z1
More data for this
Ligand-Target Pair
Chromatin remodeling regulator CECR2
(Homo sapiens (Human))
BDBM50098311
(CHEMBL3590408)
Show SMILES
CN1CC[C@@H](Nc2ncc(-c3cncc(C)c3)c3cc(C)c(=O)[nH]c23)[C@@H](C1)OCC1CCS(=O)(=O)CC1 |r|
Show InChI
PDB
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
CHEMBL
PC cid
PC sid
UniChem
Similars
Article
PubMed
794
n/a
n/a
n/a
n/a
n/a
n/a
n/a
n/a
GlaxoSmithKline
Curated by
ChEMBL
Assay Description
Binding affinity to CECR2 (unknown origin) by BROMOscan panel based assay
J Med Chem
58:
6151
-
78
(2015)
Article DOI:
10.1021/acs.jmedchem.5b00773
BindingDB Entry DOI:
10.7270/Q2FN17Z1
More data for this
Ligand-Target Pair
Bromodomain and PHD finger-containing protein 3
(Homo sapiens (Human))
BDBM50098311
(CHEMBL3590408)
Show SMILES
CN1CC[C@@H](Nc2ncc(-c3cncc(C)c3)c3cc(C)c(=O)[nH]c23)[C@@H](C1)OCC1CCS(=O)(=O)CC1 |r|
Show InChI
PDB
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
CHEMBL
PC cid
PC sid
UniChem
Similars
Article
PubMed
794
n/a
n/a
n/a
n/a
n/a
n/a
n/a
n/a
GlaxoSmithKline
Curated by
ChEMBL
Assay Description
Binding affinity to BRPF3 (unknown origin) by BROMOscan panel based assay
J Med Chem
58:
6151
-
78
(2015)
Article DOI:
10.1021/acs.jmedchem.5b00773
BindingDB Entry DOI:
10.7270/Q2FN17Z1
More data for this
Ligand-Target Pair
Peregrin
(Homo sapiens (Human))
BDBM50098311
(CHEMBL3590408)
Show SMILES
CN1CC[C@@H](Nc2ncc(-c3cncc(C)c3)c3cc(C)c(=O)[nH]c23)[C@@H](C1)OCC1CCS(=O)(=O)CC1 |r|
Show InChI
PDB
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
CHEMBL
PC cid
PC sid
UniChem
Similars
Article
PubMed
5.01E+3
n/a
n/a
n/a
n/a
n/a
n/a
n/a
n/a
GlaxoSmithKline
Curated by
ChEMBL
Assay Description
Binding affinity to BRPF1 (unknown origin) by BROMOscan panel based assay
J Med Chem
58:
6151
-
78
(2015)
Article DOI:
10.1021/acs.jmedchem.5b00773
BindingDB Entry DOI:
10.7270/Q2FN17Z1
More data for this
Ligand-Target Pair
Bromodomain-containing protein 4
(Homo sapiens (Human))
BDBM50098311
(CHEMBL3590408)
Show SMILES
CN1CC[C@@H](Nc2ncc(-c3cncc(C)c3)c3cc(C)c(=O)[nH]c23)[C@@H](C1)OCC1CCS(=O)(=O)CC1 |r|
Show InChI
PDB
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
CHEMBL
PC cid
PC sid
UniChem
Similars
Article
PubMed
7.94E+3
n/a
n/a
n/a
n/a
n/a
n/a
n/a
n/a
GlaxoSmithKline
Curated by
ChEMBL
Assay Description
Binding affinity to BRD4 BD1 (unknown origin) by BROMOscan panel based assay
J Med Chem
58:
6151
-
78
(2015)
Article DOI:
10.1021/acs.jmedchem.5b00773
BindingDB Entry DOI:
10.7270/Q2FN17Z1
More data for this
Ligand-Target Pair
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