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Compile Data Set for Download or QSAR

Found 3 hits Enz. Inhib. hit(s) with Target = 'Dopamine D1 receptor' and Ligand = 'BDBM337383'   
Target/Host
(Institution)
LigandTarget/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
pHTemp
°C
Dopamine D1 receptor


(Homo sapiens (Human))
BDBM337383
PNG
(US9745317, 21 | US9745317, 22 | US9745317, 23)
Show SMILES Cc1cc(Oc2nccc3OCCc23)ccc1-c1c(C)ncc(=O)n1C
Show InChI InChI=1S/C20H19N3O3/c1-12-10-14(26-20-16-7-9-25-17(16)6-8-21-20)4-5-15(12)19-13(2)22-11-18(24)23(19)3/h4-6,8,10-11H,7,9H2,1-3H3
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
PC cid
PC sid
UniChem
US Patent
82.5n/an/an/an/an/an/an/an/a



Pfizer Inc.

US Patent


Assay Description
D1 binding assays were performed using over-expressing LTK human cell lines. To determine basic assay parameters, ligand concentrations were determin...


US Patent US9745317 (2017)

More data for this
Ligand-Target Pair
Dopamine D1 receptor


(Homo sapiens (Human))
BDBM337383
PNG
(US9745317, 21 | US9745317, 22 | US9745317, 23)
Show SMILES Cc1cc(Oc2nccc3OCCc23)ccc1-c1c(C)ncc(=O)n1C
Show InChI InChI=1S/C20H19N3O3/c1-12-10-14(26-20-16-7-9-25-17(16)6-8-21-20)4-5-15(12)19-13(2)22-11-18(24)23(19)3/h4-6,8,10-11H,7,9H2,1-3H3
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
PC cid
PC sid
UniChem
US Patent
202n/an/an/an/an/an/an/an/a



Pfizer Inc.

US Patent


Assay Description
D1 binding assays were performed using over-expressing LTK human cell lines. To determine basic assay parameters, ligand concentrations were determin...


US Patent US9745317 (2017)

More data for this
Ligand-Target Pair
Dopamine D1 receptor


(Homo sapiens (Human))
BDBM337383
PNG
(US9745317, 21 | US9745317, 22 | US9745317, 23)
Show SMILES Cc1cc(Oc2nccc3OCCc23)ccc1-c1c(C)ncc(=O)n1C
Show InChI InChI=1S/C20H19N3O3/c1-12-10-14(26-20-16-7-9-25-17(16)6-8-21-20)4-5-15(12)19-13(2)22-11-18(24)23(19)3/h4-6,8,10-11H,7,9H2,1-3H3
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
PC cid
PC sid
UniChem
US Patent
706n/an/an/an/an/an/an/an/a



Pfizer Inc.

US Patent


Assay Description
D1 binding assays were performed using over-expressing LTK human cell lines. To determine basic assay parameters, ligand concentrations were determin...


US Patent US9745317 (2017)

More data for this
Ligand-Target Pair