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SMILES C1CN(CCN1)c1ccc(cc1)-c1cnc2c(cnn2c1)-c1cccc2ncccc12

InChI Key InChIKey=BBDGBGOVJPEFBT-UHFFFAOYSA-N

PDB links: 1 PDB ID matches this monomer.

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 15 hits for monomerid = 102618   

TargetSerine/threonine-protein kinase receptor R3(Mus musculus)
Massachusetts Institute of Technology

LigandPNGBDBM102618(LDN-212854)copy SMILEScopy InChI
Affinity DataIC50: 2.40nMMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2ZW1JKWPubMed
TargetBone morphogenetic protein 4(Mus musculus)
Vanderbilt University Medical Center

Curated by ChEMBL
LigandPNGBDBM102618(LDN-212854)copy SMILEScopy InChI
Affinity DataIC50: 117nMAssay Description:Inhibition of BMP4 in mouse C2C12BRA cells after 14 hrs by luciferase reporter gene assayMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2WW7K3PPubMed
TargetBone morphogenetic protein receptor type-1A(Mus musculus)
Massachusetts Institute of Technology

LigandPNGBDBM102618(LDN-212854)copy SMILEScopy InChI
Affinity DataIC50: 85.8nMMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2ZW1JKWPubMed
TargetActivin receptor type-1B(Mus musculus)
Massachusetts Institute of Technology

LigandPNGBDBM102618(LDN-212854)copy SMILEScopy InChI
Affinity DataIC50: 2.13E+3nMMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2ZW1JKWPubMed
TargetTGF-beta receptor type-1(Mus musculus)
Massachusetts Institute of Technology

LigandPNGBDBM102618(LDN-212854)copy SMILEScopy InChI
Affinity DataIC50: 9.28E+3nMMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2ZW1JKWPubMed
TargetBone morphogenetic protein receptor type-1B(Homo sapiens (Human))
Vanderbilt University Medical Center

Curated by ChEMBL
LigandPNGBDBM102618(LDN-212854)copy SMILEScopy InChI
Affinity DataIC50: 93nMAssay Description:Inhibition of ALK6 (unknown origin)More data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2WW7K3PPubMed
TargetActivin receptor type-1(Homo sapiens (Human))
Vanderbilt University Medical Center

Curated by ChEMBL
LigandPNGBDBM102618(LDN-212854)copy SMILEScopy InChI
Affinity DataIC50: 26nMAssay Description:Inhibition of ALK2 (unknown origin)More data for this Ligand-Target Pair
TargetSerine/threonine-protein kinase receptor R3(Homo sapiens (Human))
Vanderbilt University Medical Center

Curated by ChEMBL
LigandPNGBDBM102618(LDN-212854)copy SMILEScopy InChI
Affinity DataIC50: 14nMAssay Description:Inhibition of ALK1 (unknown origin)More data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2WW7K3PPubMed
TargetActivin receptor type-1B(Homo sapiens (Human))
Vanderbilt University Medical Center

Curated by ChEMBL
LigandPNGBDBM102618(LDN-212854)copy SMILEScopy InChI
Affinity DataIC50: 4.09E+3nMAssay Description:Inhibition of ALK4 (unknown origin)More data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2WW7K3PPubMed
TargetTGF-beta receptor type-1(Homo sapiens (Human))
Vanderbilt University Medical Center

Curated by ChEMBL
LigandPNGBDBM102618(LDN-212854)copy SMILEScopy InChI
Affinity DataIC50: 3.96E+3nMAssay Description:Inhibition of ALK5 (unknown origin)More data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2WW7K3PPubMed
Target5'-AMP-activated protein kinase subunit beta-1(Homo sapiens (Human))
Vanderbilt University Medical Center

Curated by ChEMBL
LigandPNGBDBM102618(LDN-212854)copy SMILEScopy InChI
Affinity DataIC50: 2.52E+3nMAssay Description:Inhibition of AMPK (unknown origin)More data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2WW7K3PPubMed
TargetBone morphogenetic protein receptor type-2(Homo sapiens (Human))
Vanderbilt University Medical Center

Curated by ChEMBL
LigandPNGBDBM102618(LDN-212854)copy SMILEScopy InChI
Affinity DataIC50: 695nMAssay Description:Inhibition of BMPR2 (unknown origin)More data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2WW7K3PPubMed
TargetBone morphogenetic protein receptor type-1A(Homo sapiens (Human))
Vanderbilt University Medical Center

Curated by ChEMBL
LigandPNGBDBM102618(LDN-212854)copy SMILEScopy InChI
Affinity DataIC50: 539nMAssay Description:Inhibition of ALK3 (unknown origin)More data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2WW7K3PPubMed
TargetTGF-beta receptor type-2(Homo sapiens (Human))
Vanderbilt University Medical Center

Curated by ChEMBL
LigandPNGBDBM102618(LDN-212854)copy SMILEScopy InChI
Affinity DataIC50: 327nMAssay Description:Inhibition of TGFBR2 (unknown origin)More data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2WW7K3PPubMed
TargetActivin receptor type-1(Mus musculus)
Massachusetts Institute of Technology

LigandPNGBDBM102618(LDN-212854)copy SMILEScopy InChI
Affinity DataIC50: 1.30nMMore data for this Ligand-Target Pair