BDBM50028837 Aldehydes, C5::CHEMBL18602::PENTANAL

SMILES: CCCCC=O

InChI Key: InChIKey=HGBOYTHUEUWSSQ-UHFFFAOYSA-N

Data: 2 IC50

PDB links: 4 PDB IDs match this monomer.

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 = 50028837   

Target/Host (Institution)	Ligand	Target/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	pH	Temp °C
Phenylethanolamine N-methyltransferase (Bos taurus (bovine))	BDBM50028837 (Aldehydes, C5 | CHEMBL18602 | PENTANAL) Show SMILES CCCCC=O Show InChI InChI=1S/C5H10O/c1-2-3-4-5-6/h5H,2-4H2,1H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL DrugBank KEGG MMDB PC cid PC sid PDB UniChem Patents	PubMed	n/a	n/a	3.45E+5	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibitory activity against phenylethanolamine N-methyltransferase				J Med Chem 24: 7-12 (1981) BindingDB Entry DOI: 10.7270/Q2PK0F59
					More data for this Ligand-Target Pair
Olfactory receptor 17 (Rattus norvegicus (Rat))	BDBM50028837 (Aldehydes, C5 | CHEMBL18602 | PENTANAL) Show SMILES CCCCC=O Show InChI InChI=1S/C5H10O/c1-2-3-4-5-6/h5H,2-4H2,1H3	KEGG UniProtKB/TrEMBL GoogleScholar AffyNet	Purchase CHEMBL DrugBank KEGG MMDB PC cid PC sid PDB UniChem Patents	Article PubMed	n/a	n/a	4.60E+5	n/a	n/a	n/a	n/a	n/a	n/a
Columbia University					Assay Description Inhibition assay of olfactory receptors 17 activation.				Chem Biol 15: 1317-27 (2008) Article DOI: 10.1016/j.chembiol.2008.10.014 BindingDB Entry DOI: 10.7270/Q21J9879
					More data for this Ligand-Target Pair