Found 6 hits in this display 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 |
|---|
X-box-binding protein 1
(Homo sapiens (Human)) | BDBM36941
(1-(8-fluoranyl-5H-pyrimido[5,4-b]indol-4-yl)-4-[3-...)Show SMILES OC1(CCN(CC1)c1ncnc2c3cc(F)ccc3[nH]c12)c1cccc(c1)C(F)(F)F Show InChI InChI=1S/C22H18F4N4O/c23-15-4-5-17-16(11-15)18-19(29-17)20(28-12-27-18)30-8-6-21(31,7-9-30)13-2-1-3-14(10-13)22(24,25)26/h1-5,10-12,29,31H,6-9H2 | PDB
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet 
| Purchase
PC cid
PC sid
UniChem
| PCBioAssay
| n/a | n/a | 2.30E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Emory University Molecular Libraries Screening Center
Curated by PubChem BioAssay
| Assay Description
NIH Molecular Libraries Screening Centers Network [MLSCN] Emory Chemical Biology Discovery Center in MLSCN Assay provider: Dr. Randal Kaufman, Univer... |
PubChem Bioassay (2011)
BindingDB Entry DOI: 10.7270/Q2NK3CGB |
More data for this
Ligand-Target Pair | |
DNA damage-inducible transcript 3 protein
(Mus musculus) | BDBM36941
(1-(8-fluoranyl-5H-pyrimido[5,4-b]indol-4-yl)-4-[3-...)Show SMILES OC1(CCN(CC1)c1ncnc2c3cc(F)ccc3[nH]c12)c1cccc(c1)C(F)(F)F Show InChI InChI=1S/C22H18F4N4O/c23-15-4-5-17-16(11-15)18-19(29-17)20(28-12-27-18)30-8-6-21(31,7-9-30)13-2-1-3-14(10-13)22(24,25)26/h1-5,10-12,29,31H,6-9H2 | KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| Purchase
PC cid
PC sid
UniChem
| PCBioAssay
| n/a | n/a | 6.68E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Emory University Molecular Libraries Screening Center
Curated by PubChem BioAssay
| Assay Description
NIH Molecular Libraries Screening Centers Network [MLSCN] Emory Chemical Biology Discovery Center in MLSCN Assay provider: Dr. Randal Kaufman, Univer... |
PubChem Bioassay (2010)
BindingDB Entry DOI: 10.7270/Q2PC30VZ |
More data for this
Ligand-Target Pair | |
DNA damage-inducible transcript 3 protein
(Mus musculus) | BDBM36941
(1-(8-fluoranyl-5H-pyrimido[5,4-b]indol-4-yl)-4-[3-...)Show SMILES OC1(CCN(CC1)c1ncnc2c3cc(F)ccc3[nH]c12)c1cccc(c1)C(F)(F)F Show InChI InChI=1S/C22H18F4N4O/c23-15-4-5-17-16(11-15)18-19(29-17)20(28-12-27-18)30-8-6-21(31,7-9-30)13-2-1-3-14(10-13)22(24,25)26/h1-5,10-12,29,31H,6-9H2 | KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| Purchase
PC cid
PC sid
UniChem
| PCBioAssay
| n/a | n/a | 6.68E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Emory University Molecular Libraries Screening Center
Curated by PubChem BioAssay
| Assay Description
NIH Molecular Libraries Screening Centers Network [MLSCN] Emory Chemical Biology Discovery Center in MLSCN Assay provider: Dr. Randal Kaufman, Univer... |
PubChem Bioassay (2011)
BindingDB Entry DOI: 10.7270/Q28C9TQN |
More data for this
Ligand-Target Pair | |
Sphingosine 1-phosphate receptor 1
(Homo sapiens (Human)) | BDBM36941
(1-(8-fluoranyl-5H-pyrimido[5,4-b]indol-4-yl)-4-[3-...)Show SMILES OC1(CCN(CC1)c1ncnc2c3cc(F)ccc3[nH]c12)c1cccc(c1)C(F)(F)F Show InChI InChI=1S/C22H18F4N4O/c23-15-4-5-17-16(11-15)18-19(29-17)20(28-12-27-18)30-8-6-21(31,7-9-30)13-2-1-3-14(10-13)22(24,25)26/h1-5,10-12,29,31H,6-9H2 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| Purchase
PC cid
PC sid
UniChem
| PCBioAssay
| n/a | n/a | n/a | n/a | >3.00E+3 | n/a | n/a | n/a | n/a |
The Scripps Research Institute Molecular Screening Center
Curated by PubChem BioAssay
| Assay Description
Source (MLSCN Center Name): The Scripps Research Institute Molecular Screening Center Center Affiliation: The Scripps Research Institute, TSRI Assay ... |
PubChem Bioassay (2007)
BindingDB Entry DOI: 10.7270/Q25X2795 |
More data for this
Ligand-Target Pair | |
Sphingosine 1-phosphate receptor 1
(Homo sapiens (Human)) | BDBM36941
(1-(8-fluoranyl-5H-pyrimido[5,4-b]indol-4-yl)-4-[3-...)Show SMILES OC1(CCN(CC1)c1ncnc2c3cc(F)ccc3[nH]c12)c1cccc(c1)C(F)(F)F Show InChI InChI=1S/C22H18F4N4O/c23-15-4-5-17-16(11-15)18-19(29-17)20(28-12-27-18)30-8-6-21(31,7-9-30)13-2-1-3-14(10-13)22(24,25)26/h1-5,10-12,29,31H,6-9H2 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| Purchase
PC cid
PC sid
UniChem
| PCBioAssay
| n/a | n/a | n/a | n/a | 4.41E+3 | n/a | n/a | n/a | n/a |
The Scripps Research Institute Molecular Screening Center
Curated by PubChem BioAssay
| Assay Description
Source (MLSCN Center Name): The Scripps Research Institute Molecular Screening Center Center Affiliation: The Scripps Research Institute, TSRI Assay ... |
PubChem Bioassay (2007)
BindingDB Entry DOI: 10.7270/Q2ZC817P |
More data for this
Ligand-Target Pair | |
Sphingosine 1-phosphate receptor 1
(Homo sapiens (Human)) | BDBM36941
(1-(8-fluoranyl-5H-pyrimido[5,4-b]indol-4-yl)-4-[3-...)Show SMILES OC1(CCN(CC1)c1ncnc2c3cc(F)ccc3[nH]c12)c1cccc(c1)C(F)(F)F Show InChI InChI=1S/C22H18F4N4O/c23-15-4-5-17-16(11-15)18-19(29-17)20(28-12-27-18)30-8-6-21(31,7-9-30)13-2-1-3-14(10-13)22(24,25)26/h1-5,10-12,29,31H,6-9H2 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| Purchase
PC cid
PC sid
UniChem
| PCBioAssay
| n/a | n/a | n/a | n/a | 3.91E+3 | n/a | n/a | n/a | n/a |
The Scripps Research Institute Molecular Screening Center
Curated by PubChem BioAssay
| Assay Description
Source (MLSCN Center Name): The Scripps Research Institute Molecular Screening Center Center Affiliation: The Scripps Research Institute, TSRI Assay ... |
PubChem Bioassay (2007)
BindingDB Entry DOI: 10.7270/Q2251GJ9 |
More data for this
Ligand-Target Pair | |