BindingDB PrimarySearch

null

SMILES: OC1CCN(CCCN2c3ccccc3Sc3ccc(cc23)C#N)CC1

InChI Key: InChIKey=LUALIOATIOESLM-UHFFFAOYSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 8 hits for monomerid = 50346422
Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	k_off s^-1	k_on M^-1s^-1	pH	Temp °C
Alpha-1A adrenergic receptor (Rattus norvegicus (Rat))	BDBM50346422 (10-(3-(4-hydroxypiperidin-1-yl)propyl)-10H-phenoth...) Show SMILES OC1CCN(CCCN2c3ccccc3Sc3ccc(cc23)C#N)CC1 Show InChI	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE PC cid PC sid UniChem Similars	Article PubMed	4.10	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Janssen Pharmaceutica Curated by PDSP K_i Database									Eur J Pharmacol 129: 49-55 (1986) Article DOI: 10.1016/0014-2999(86)90335-3 BindingDB Entry DOI: 10.7270/Q27S7M8D
Janssen Pharmaceutica Curated by PDSP K_i Database					More data for this Ligand-Target Pair
Alpha-2C adrenergic receptor (RAT)	BDBM50346422 (10-(3-(4-hydroxypiperidin-1-yl)propyl)-10H-phenoth...) Show SMILES OC1CCN(CCCN2c3ccccc3Sc3ccc(cc23)C#N)CC1 Show InChI	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE PC cid PC sid UniChem Similars	Article PubMed	160	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Janssen Pharmaceutica Curated by PDSP K_i Database									Eur J Pharmacol 129: 49-55 (1986) Article DOI: 10.1016/0014-2999(86)90335-3 BindingDB Entry DOI: 10.7270/Q27S7M8D
Janssen Pharmaceutica Curated by PDSP K_i Database					More data for this Ligand-Target Pair
Alpha-2C adrenergic receptor (RAT)	BDBM50346422 (10-(3-(4-hydroxypiperidin-1-yl)propyl)-10H-phenoth...) Show SMILES OC1CCN(CCCN2c3ccccc3Sc3ccc(cc23)C#N)CC1 Show InChI	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE PC cid PC sid UniChem Similars	Article PubMed	220	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Janssen Pharmaceutica Curated by PDSP K_i Database									Eur J Pharmacol 129: 49-55 (1986) Article DOI: 10.1016/0014-2999(86)90335-3 BindingDB Entry DOI: 10.7270/Q27S7M8D
Janssen Pharmaceutica Curated by PDSP K_i Database					More data for this Ligand-Target Pair
Alpha-2C adrenergic receptor (RAT)	BDBM50346422 (10-(3-(4-hydroxypiperidin-1-yl)propyl)-10H-phenoth...) Show SMILES OC1CCN(CCCN2c3ccccc3Sc3ccc(cc23)C#N)CC1 Show InChI	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE PC cid PC sid UniChem Similars	Article PubMed	2.00E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Janssen Pharmaceutica Curated by PDSP K_i Database									Eur J Pharmacol 129: 49-55 (1986) Article DOI: 10.1016/0014-2999(86)90335-3 BindingDB Entry DOI: 10.7270/Q27S7M8D
Janssen Pharmaceutica Curated by PDSP K_i Database					More data for this Ligand-Target Pair
Androgen receptor (Rattus norvegicus (Rat))	BDBM50346422 (10-(3-(4-hydroxypiperidin-1-yl)propyl)-10H-phenoth...) Show SMILES OC1CCN(CCCN2c3ccccc3Sc3ccc(cc23)C#N)CC1 Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE PC cid PC sid UniChem Similars	Article PubMed	3.00E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
The Scripps Research Institute Curated by ChEMBL					Assay Description Displacement of [3H]mibolerone from rat androgen receptor				Proc Natl Acad Sci USA 104: 11927-32 (2007) Article DOI: 10.1073/pnas.0609752104 BindingDB Entry DOI: 10.7270/Q2MP544F
The Scripps Research Institute Curated by ChEMBL					More data for this Ligand-Target Pair
Alpha-2C adrenergic receptor (RAT)	BDBM50346422 (10-(3-(4-hydroxypiperidin-1-yl)propyl)-10H-phenoth...) Show SMILES OC1CCN(CCCN2c3ccccc3Sc3ccc(cc23)C#N)CC1 Show InChI	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE PC cid PC sid UniChem Similars	Article PubMed	3.20E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Janssen Pharmaceutica Curated by PDSP K_i Database									Eur J Pharmacol 129: 49-55 (1986) Article DOI: 10.1016/0014-2999(86)90335-3 BindingDB Entry DOI: 10.7270/Q27S7M8D
Janssen Pharmaceutica Curated by PDSP K_i Database					More data for this Ligand-Target Pair
Cholinesterase (Equus caballus (Horse))	BDBM50346422 (10-(3-(4-hydroxypiperidin-1-yl)propyl)-10H-phenoth...) Show SMILES OC1CCN(CCCN2c3ccccc3Sc3ccc(cc23)C#N)CC1 Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	230	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Genova Curated by ChEMBL					Assay Description Inhibition of Equine serum BChE using butyrylthiocoline iodide as a substrate after 20 mins by Ellman's assay				Eur J Med Chem 46: 2170-84 (2011) Article DOI: 10.1016/j.ejmech.2011.02.071 BindingDB Entry DOI: 10.7270/Q2BK1CPG
Universit£ degli Studi di Genova Curated by ChEMBL					More data for this Ligand-Target Pair
Acetylcholinesterase (Bos taurus (bovine))	BDBM50346422 (10-(3-(4-hydroxypiperidin-1-yl)propyl)-10H-phenoth...) Show SMILES OC1CCN(CCCN2c3ccccc3Sc3ccc(cc23)C#N)CC1 Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	7.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Genova Curated by ChEMBL					Assay Description Inhibition of bovine erythrocyte AChE using acetylthiocholine iodide as a substrate after 20 mins by Ellman's assay				Eur J Med Chem 46: 2170-84 (2011) Article DOI: 10.1016/j.ejmech.2011.02.071 BindingDB Entry DOI: 10.7270/Q2BK1CPG
Universit£ degli Studi di Genova Curated by ChEMBL					More data for this Ligand-Target Pair