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Target
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Compile Data Set for Download or QSAR
Found
2
hits Enz. Inhib. hit(s) with Target = 'Bone morphogenetic protein receptor type-2' and Ligand = 'BDBM50262685'
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
Bone morphogenetic protein receptor type-2
(Homo sapiens (Human))
BDBM50262685
(6-(4-(2-(piperidin-1-yl)ethoxy)phenyl)-3-(pyridin-...)
Show SMILES
C(CN1CCCCC1)Oc1ccc(cc1)-c1cnc2c(cnn2c1)-c1ccncc1
Show InChI
InChI=1S/C24H25N5O/c1-2-12-28(13-3-1)14-15-30-22-6-4-19(5-7-22)21-16-26-24-23(17-27-29(24)18-21)20-8-10-25-11-9-20/h4-11,16-18H,1-3,12-15H2
PDB
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PC cid
PC sid
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n/a
n/a
74
n/a
n/a
n/a
n/a
n/a
n/a
TBA
Citation and Details
More data for this
Ligand-Target Pair
Bone morphogenetic protein receptor type-2
(Homo sapiens (Human))
BDBM50262685
(6-(4-(2-(piperidin-1-yl)ethoxy)phenyl)-3-(pyridin-...)
Show SMILES
C(CN1CCCCC1)Oc1ccc(cc1)-c1cnc2c(cnn2c1)-c1ccncc1
Show InChI
InChI=1S/C24H25N5O/c1-2-12-28(13-3-1)14-15-30-22-6-4-19(5-7-22)21-16-26-24-23(17-27-29(24)18-21)20-8-10-25-11-9-20/h4-11,16-18H,1-3,12-15H2
PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
Purchase
CHEMBL
DrugBank
MCE
PC cid
PC sid
PDB
UniChem
Patents
Similars
Article
PubMed
n/a
n/a
74
n/a
n/a
n/a
n/a
n/a
n/a
Vanderbilt University Medical Center
Curated by
ChEMBL
Assay Description
Inhibition of BMPR2 (unknown origin)
Bioorg Med Chem Lett
23:
3248
-
52
(2013)
Article DOI:
10.1016/j.bmcl.2013.03.113
BindingDB Entry DOI:
10.7270/Q2WW7K3P
More data for this
Ligand-Target Pair