Found 5 hits for monomerid = 50578787 Target/Host
(Institution) | Ligand | Target/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 | pH | Temp
°C |
|---|
Cytochrome P450 3A4
(Homo sapiens (Human)) | BDBM50578787
(CHEMBL4874801)Show SMILES COCCNc1nc2cnc3cc(-c4c(C)noc4C)c(OC)cc3c2n1[C@H](C)c1ccccn1 |r,wD:27.31,(40.22,-48.31,;39.45,-46.98,;37.91,-46.98,;37.14,-45.65,;35.6,-45.65,;34.83,-46.99,;35.46,-48.39,;34.32,-49.42,;34.34,-50.97,;33,-51.74,;31.67,-50.97,;30.33,-51.75,;29,-50.98,;27.66,-51.75,;26.26,-51.13,;25.94,-49.62,;25.23,-52.27,;26,-53.61,;27.51,-53.29,;28.65,-54.32,;29,-49.44,;27.67,-48.67,;27.67,-47.13,;30.33,-48.67,;31.67,-49.43,;32.99,-48.66,;33.31,-47.16,;32.27,-46.02,;30.77,-46.34,;32.74,-44.55,;34.25,-44.23,;34.72,-42.77,;33.68,-41.63,;32.17,-41.96,;31.71,-43.42,)| | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
| PC cid
PC sid
UniChem
| | n/a | n/a | 7.90E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Bromodomain-containing protein 4
(Homo sapiens (Human)) | BDBM50578787
(CHEMBL4874801)Show SMILES COCCNc1nc2cnc3cc(-c4c(C)noc4C)c(OC)cc3c2n1[C@H](C)c1ccccn1 |r,wD:27.31,(40.22,-48.31,;39.45,-46.98,;37.91,-46.98,;37.14,-45.65,;35.6,-45.65,;34.83,-46.99,;35.46,-48.39,;34.32,-49.42,;34.34,-50.97,;33,-51.74,;31.67,-50.97,;30.33,-51.75,;29,-50.98,;27.66,-51.75,;26.26,-51.13,;25.94,-49.62,;25.23,-52.27,;26,-53.61,;27.51,-53.29,;28.65,-54.32,;29,-49.44,;27.67,-48.67,;27.67,-47.13,;30.33,-48.67,;31.67,-49.43,;32.99,-48.66,;33.31,-47.16,;32.27,-46.02,;30.77,-46.34,;32.74,-44.55,;34.25,-44.23,;34.72,-42.77,;33.68,-41.63,;32.17,-41.96,;31.71,-43.42,)| | PDB
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 25 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Bromodomain-containing protein 4
(Homo sapiens (Human)) | BDBM50578787
(CHEMBL4874801)Show SMILES COCCNc1nc2cnc3cc(-c4c(C)noc4C)c(OC)cc3c2n1[C@H](C)c1ccccn1 |r,wD:27.31,(40.22,-48.31,;39.45,-46.98,;37.91,-46.98,;37.14,-45.65,;35.6,-45.65,;34.83,-46.99,;35.46,-48.39,;34.32,-49.42,;34.34,-50.97,;33,-51.74,;31.67,-50.97,;30.33,-51.75,;29,-50.98,;27.66,-51.75,;26.26,-51.13,;25.94,-49.62,;25.23,-52.27,;26,-53.61,;27.51,-53.29,;28.65,-54.32,;29,-49.44,;27.67,-48.67,;27.67,-47.13,;30.33,-48.67,;31.67,-49.43,;32.99,-48.66,;33.31,-47.16,;32.27,-46.02,;30.77,-46.34,;32.74,-44.55,;34.25,-44.23,;34.72,-42.77,;33.68,-41.63,;32.17,-41.96,;31.71,-43.42,)| | PDB
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 13 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Cytochrome P450 2C9
(Homo sapiens (Human)) | BDBM50578787
(CHEMBL4874801)Show SMILES COCCNc1nc2cnc3cc(-c4c(C)noc4C)c(OC)cc3c2n1[C@H](C)c1ccccn1 |r,wD:27.31,(40.22,-48.31,;39.45,-46.98,;37.91,-46.98,;37.14,-45.65,;35.6,-45.65,;34.83,-46.99,;35.46,-48.39,;34.32,-49.42,;34.34,-50.97,;33,-51.74,;31.67,-50.97,;30.33,-51.75,;29,-50.98,;27.66,-51.75,;26.26,-51.13,;25.94,-49.62,;25.23,-52.27,;26,-53.61,;27.51,-53.29,;28.65,-54.32,;29,-49.44,;27.67,-48.67,;27.67,-47.13,;30.33,-48.67,;31.67,-49.43,;32.99,-48.66,;33.31,-47.16,;32.27,-46.02,;30.77,-46.34,;32.74,-44.55,;34.25,-44.23,;34.72,-42.77,;33.68,-41.63,;32.17,-41.96,;31.71,-43.42,)| | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 7.90E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Bromodomain-containing protein 4
(Homo sapiens (Human)) | BDBM50578787
(CHEMBL4874801)Show SMILES COCCNc1nc2cnc3cc(-c4c(C)noc4C)c(OC)cc3c2n1[C@H](C)c1ccccn1 |r,wD:27.31,(40.22,-48.31,;39.45,-46.98,;37.91,-46.98,;37.14,-45.65,;35.6,-45.65,;34.83,-46.99,;35.46,-48.39,;34.32,-49.42,;34.34,-50.97,;33,-51.74,;31.67,-50.97,;30.33,-51.75,;29,-50.98,;27.66,-51.75,;26.26,-51.13,;25.94,-49.62,;25.23,-52.27,;26,-53.61,;27.51,-53.29,;28.65,-54.32,;29,-49.44,;27.67,-48.67,;27.67,-47.13,;30.33,-48.67,;31.67,-49.43,;32.99,-48.66,;33.31,-47.16,;32.27,-46.02,;30.77,-46.34,;32.74,-44.55,;34.25,-44.23,;34.72,-42.77,;33.68,-41.63,;32.17,-41.96,;31.71,-43.42,)| | PDB
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 158 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
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