BDBM50389589 CHEMBL2069501
SMILES: CCOCC1(COCC)N[C@H](Cc2c1[nH]c1ccccc21)c1nc(c[nH]1)-c1ccccc1
InChI Key: InChIKey=JGAPWJRMEQDHGG-JOCHJYFZSA-N
Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB
Found 2 hits for monomerid = 50389589 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 |
|---|
Potassium voltage-gated channel subfamily H member 2
(Homo sapiens (Human)) | BDBM50389589
(CHEMBL2069501)Show SMILES CCOCC1(COCC)N[C@H](Cc2c1[nH]c1ccccc21)c1nc(c[nH]1)-c1ccccc1 |r| Show InChI InChI=1S/C26H30N4O2/c1-3-31-16-26(17-32-4-2)24-20(19-12-8-9-13-21(19)28-24)14-22(30-26)25-27-15-23(29-25)18-10-6-5-7-11-18/h5-13,15,22,28,30H,3-4,14,16-17H2,1-2H3,(H,27,29)/t22-/m1/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
UniProtKB/TrEMBL
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 176 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Displacement of [35S]MK499 from human Erg expressed in HEK293 cells after 60 mins by scintillation counting |
ACS Med Chem Lett 3: 289-293 (2012)
Article DOI: 10.1021/ml200272z
BindingDB Entry DOI: 10.7270/Q2K938MH |
More data for this
Ligand-Target Pair | |
Somatostatin receptor type 3
(Homo sapiens (Human)) | BDBM50389589
(CHEMBL2069501)Show SMILES CCOCC1(COCC)N[C@H](Cc2c1[nH]c1ccccc21)c1nc(c[nH]1)-c1ccccc1 |r| Show InChI InChI=1S/C26H30N4O2/c1-3-31-16-26(17-32-4-2)24-20(19-12-8-9-13-21(19)28-24)14-22(30-26)25-27-15-23(29-25)18-10-6-5-7-11-18/h5-13,15,22,28,30H,3-4,14,16-17H2,1-2H3,(H,27,29)/t22-/m1/s1 | Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | 2 | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Antagonist activity at human SST3 receptor |
ACS Med Chem Lett 3: 289-293 (2012)
Article DOI: 10.1021/ml200272z
BindingDB Entry DOI: 10.7270/Q2K938MH |
More data for this
Ligand-Target Pair | |
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