BDBM50031459 (2Z,4E6E,8E)-3,7-dimethyl-9-(2,6,6-trimethylcyclohex-1-en-1-yl)nona-2,4,6,8-tetraenoic acid::(7E,9E,11E,13Z)-retinoic acid::13-RA::13-cis-Vitamin A acid::13-cis-retinoic acid::CHEMBL547::Neovitamin A acid::isotretinoin

SMILES C\C(\C=C\C1=C(C)CCCC1(C)C)=C/C=C/C(/C)=C\C(O)=O

InChI Key InChIKey=SHGAZHPCJJPHSC-XFYACQKRSA-N

Data  13 IC50  2 Kd

PDB links: 22 PDB IDs match this monomer.

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Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50031459   

TargetCellular retinoic acid-binding protein 1(Gallus gallus)
University Of Alabama At Birmingham

Curated by ChEMBL
LigandPNGBDBM50031459((2Z,4E6E,8E)-3,7-dimethyl-9-(2,6,6-trimethylcycloh...)
Affinity DataIC50:  900nMAssay Description:Inhibition of binding to chick skin Cytoplasmic retinoic acid binding proteinMore data for this Ligand-Target Pair
TargetCellular retinoic acid-binding protein 1(Mus musculus)
University Of Alabama At Birmingham

Curated by ChEMBL
LigandPNGBDBM50031459((2Z,4E6E,8E)-3,7-dimethyl-9-(2,6,6-trimethylcycloh...)
Affinity DataKd: >200nMAssay Description:Binding affinity for mouse Cytoplasmic retinoic acid binding protein type 1More data for this Ligand-Target Pair
TargetCellular retinoic acid-binding protein 1(Gallus gallus)
University Of Alabama At Birmingham

Curated by ChEMBL
LigandPNGBDBM50031459((2Z,4E6E,8E)-3,7-dimethyl-9-(2,6,6-trimethylcycloh...)
Affinity DataIC50:  900nMAssay Description:Tested for its ability to inhibit the binding of (all-E-)-RA to cytoplasmic retinoic acid-binding protein (CRABP) from chick skinMore data for this Ligand-Target Pair