BDBM50064273 CHEMBL295209::N-Cyclohexyl-N-propyl-formamide

SMILES: CCCN(C=O)C1CCCCC1

InChI Key: InChIKey=HWFIBRXIRGWMDC-UHFFFAOYSA-N

Data: 3 KI

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 3 hits for monomerid = 50064273   

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
Alcohol dehydrogenase (Homo sapiens (Human))	BDBM50064273 (CHEMBL295209 | N-Cyclohexyl-N-propyl-formamide) Show SMILES CCCN(C=O)C1CCCCC1 Show InChI InChI=1S/C10H19NO/c1-2-8-11(9-12)10-6-4-3-5-7-10/h9-10H,2-8H2,1H3	PDB MMDB Reactome pathway KEGG B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	1.40E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
The University of Iowa Curated by ChEMBL					Assay Description Inhibition of human alcohol dehydrogenase alpha activity				J Med Chem 41: 1696-701 (1998) Article DOI: 10.1021/jm9707380 BindingDB Entry DOI: 10.7270/Q2VM4BC5
					More data for this Ligand-Target Pair
Alcohol dehydrogenase (Homo sapiens (Human))	BDBM50064273 (CHEMBL295209 | N-Cyclohexyl-N-propyl-formamide) Show SMILES CCCN(C=O)C1CCCCC1 Show InChI InChI=1S/C10H19NO/c1-2-8-11(9-12)10-6-4-3-5-7-10/h9-10H,2-8H2,1H3	PDB MMDB Reactome pathway KEGG B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	1.60E+5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
The University of Iowa Curated by ChEMBL					Assay Description Inhibition of human alcohol dehydrogenase gamma2 activity				J Med Chem 41: 1696-701 (1998) Article DOI: 10.1021/jm9707380 BindingDB Entry DOI: 10.7270/Q2VM4BC5
					More data for this Ligand-Target Pair
Alcohol dehydrogenase (Homo sapiens (Human))	BDBM50064273 (CHEMBL295209 | N-Cyclohexyl-N-propyl-formamide) Show SMILES CCCN(C=O)C1CCCCC1 Show InChI InChI=1S/C10H19NO/c1-2-8-11(9-12)10-6-4-3-5-7-10/h9-10H,2-8H2,1H3	PDB MMDB Reactome pathway KEGG B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	4.00E+6	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
The University of Iowa Curated by ChEMBL					Assay Description Inhibition of human alcohol dehydrogenase beta 1 activity				J Med Chem 41: 1696-701 (1998) Article DOI: 10.1021/jm9707380 BindingDB Entry DOI: 10.7270/Q2VM4BC5
					More data for this Ligand-Target Pair