BindingDB logo
myBDB logout

null

SMILES: Cc1cc2c(c(C)c1C(=O)Nc1ccc(CC(O)=O)cc1)C(C)(C)CCC2(C)C

InChI Key: InChIKey=QWFCVDPZBKASNN-UHFFFAOYSA-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 4 hits for monomerid = 476228   
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
Cytochrome P450 26A1


(Homo sapiens (Human))
BDBM476228
PNG
(US10874634, Cmpd No. 10 | US11364220, Compound 10)
Show SMILES Cc1cc2c(c(C)c1C(=O)Nc1ccc(CC(O)=O)cc1)C(C)(C)CCC2(C)C
Show InChI InChI=1S/C25H31NO3/c1-15-13-19-22(25(5,6)12-11-24(19,3)4)16(2)21(15)23(29)26-18-9-7-17(8-10-18)14-20(27)28/h7-10,13H,11-12,14H2,1-6H3,(H,26,29)(H,27,28)
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
KEGG
PC cid
PC sid
UniChem
US Patent
n/an/a 8.23E+3n/an/an/an/an/an/a



Queen''s University at Kingston

US Patent


Assay Description
CYP26A1 or CYP26B1 stably transfected HeLa cells were maintained in Minimum Essential Medium (MEM) containing 10% fetal bovine serum (FBS) and 100 &#...


US Patent US10874634 (2020)

More data for this
Ligand-Target Pair
Cytochrome P450 26B1


(Homo sapiens (Human))
BDBM476228
PNG
(US10874634, Cmpd No. 10 | US11364220, Compound 10)
Show SMILES Cc1cc2c(c(C)c1C(=O)Nc1ccc(CC(O)=O)cc1)C(C)(C)CCC2(C)C
Show InChI InChI=1S/C25H31NO3/c1-15-13-19-22(25(5,6)12-11-24(19,3)4)16(2)21(15)23(29)26-18-9-7-17(8-10-18)14-20(27)28/h7-10,13H,11-12,14H2,1-6H3,(H,26,29)(H,27,28)
UniProtKB/SwissProt

GoogleScholar
AffyNet 
KEGG
PC cid
PC sid
UniChem
n/an/a 550n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Cytochrome P450 26A1


(Homo sapiens (Human))
BDBM476228
PNG
(US10874634, Cmpd No. 10 | US11364220, Compound 10)
Show SMILES Cc1cc2c(c(C)c1C(=O)Nc1ccc(CC(O)=O)cc1)C(C)(C)CCC2(C)C
Show InChI InChI=1S/C25H31NO3/c1-15-13-19-22(25(5,6)12-11-24(19,3)4)16(2)21(15)23(29)26-18-9-7-17(8-10-18)14-20(27)28/h7-10,13H,11-12,14H2,1-6H3,(H,26,29)(H,27,28)
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
KEGG
PC cid
PC sid
UniChem
n/an/a 8.23E+3n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Cytochrome P450 26B1


(Homo sapiens (Human))
BDBM476228
PNG
(US10874634, Cmpd No. 10 | US11364220, Compound 10)
Show SMILES Cc1cc2c(c(C)c1C(=O)Nc1ccc(CC(O)=O)cc1)C(C)(C)CCC2(C)C
Show InChI InChI=1S/C25H31NO3/c1-15-13-19-22(25(5,6)12-11-24(19,3)4)16(2)21(15)23(29)26-18-9-7-17(8-10-18)14-20(27)28/h7-10,13H,11-12,14H2,1-6H3,(H,26,29)(H,27,28)
UniProtKB/SwissProt

GoogleScholar
AffyNet 
KEGG
PC cid
PC sid
UniChem
US Patent
n/an/a 550n/an/an/an/an/an/a



Queen''s University at Kingston

US Patent


Assay Description
CYP26A1 or CYP26B1 stably transfected HeLa cells were maintained in Minimum Essential Medium (MEM) containing 10% fetal bovine serum (FBS) and 100 &#...


US Patent US10874634 (2020)

More data for this
Ligand-Target Pair