BindingDB logo
myBDB logout

null

SMILES: COc1cc(ccc1-c1ccccc1C)C(=O)N1C[C@]2(C)C[C@H]1CC(C)(C)C2

InChI Key: InChIKey=VMDRSUUJIYCIKH-KBMIEXCESA-N

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50319778   
Target/Host
(Institution)
LigandTarget/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
pHTemp
°C
Vasopressin V1a receptor


(Homo sapiens (Human))
BDBM50319778
PNG
((2-methoxy-2'-methylbiphenyl-4-yl)((1S,5R)-1,3,3-t...)
Show SMILES COc1cc(ccc1-c1ccccc1C)C(=O)N1C[C@]2(C)C[C@H]1CC(C)(C)C2 |r|
Show InChI InChI=1S/C25H31NO2/c1-17-8-6-7-9-20(17)21-11-10-18(12-22(21)28-5)23(27)26-16-25(4)14-19(26)13-24(2,3)15-25/h6-12,19H,13-16H2,1-5H3/t19-,25-/m1/s1
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
20n/an/an/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Displacement [3H]Arg human recombinant Vasopressin V1a receptor


Bioorg Med Chem Lett 20: 3742-5 (2010)


Article DOI: 10.1016/j.bmcl.2010.04.068
BindingDB Entry DOI: 10.7270/Q24F1QW2
More data for this
Ligand-Target Pair
Vasopressin V2 receptor


(Homo sapiens (Human))
BDBM50319778
PNG
((2-methoxy-2'-methylbiphenyl-4-yl)((1S,5R)-1,3,3-t...)
Show SMILES COc1cc(ccc1-c1ccccc1C)C(=O)N1C[C@]2(C)C[C@H]1CC(C)(C)C2 |r|
Show InChI InChI=1S/C25H31NO2/c1-17-8-6-7-9-20(17)21-11-10-18(12-22(21)28-5)23(27)26-16-25(4)14-19(26)13-24(2,3)15-25/h6-12,19H,13-16H2,1-5H3/t19-,25-/m1/s1
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
82n/an/an/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Displacement [3H]Arg human recombinant Vasopressin V2 receptor


Bioorg Med Chem Lett 20: 3742-5 (2010)


Article DOI: 10.1016/j.bmcl.2010.04.068
BindingDB Entry DOI: 10.7270/Q24F1QW2
More data for this
Ligand-Target Pair