BDBM50088429 Acitretin::CHEBI:50173::Etretin::Ro-101670000::Soriatane

SMILES: COc1cc(C)c(\C=C\C(\C)=C\C=C\C(\C)=C\C(O)=O)c(C)c1C

InChI Key: InChIKey=IHUNBGSDBOWDMA-UHFFFAOYSA-N

Data: 5 IC50

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 5 hits for monomerid = 50088429   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
ATP-binding cassette sub-family C member 3 (Human)	BDBM50088429 (CHEBI:50173 | Acitretin | Etretin | Ro-101670000 |...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	>1.33E+5	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Bile salt export pump (Human)	BDBM50088429 (CHEBI:50173 | Acitretin | Etretin | Ro-101670000 |...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	3.82E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
ATP-binding cassette sub-family C member 4 (Human)	BDBM50088429 (CHEBI:50173 | Acitretin | Etretin | Ro-101670000 |...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	4.90E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Bile salt export pump (Human)	BDBM50088429 (CHEBI:50173 | Acitretin | Etretin | Ro-101670000 |...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1.82E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Bile salt export pump (Rat)	BDBM50088429 (CHEBI:50173 | Acitretin | Etretin | Ro-101670000 |...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1.97E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair