BDBM50473568 CHEMBL354112

SMILES: C[C@@]1(C[C@H]2CN=CN2)CCc2ccccc2C1

InChI Key: InChIKey=FSAVOJFESJPQEK-LSDHHAIUSA-N

Data: 4 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 4 hits for monomerid = 50473568   

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
Sodium-dependent serotonin transporter (Rattus norvegicus (rat))	BDBM50473568 (CHEMBL354112) Show SMILES C[C@@]1(C[C@H]2CN=CN2)CCc2ccccc2C1 |c:5| Show InChI InChI=1S/C15H20N2/c1-15(9-14-10-16-11-17-14)7-6-12-4-2-3-5-13(12)8-15/h2-5,11,14H,6-10H2,1H3,(H,16,17)/t14-,15+/m0/s1	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	32	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Institut de Recherches Servier Curated by PDSP Ki Database					Assay Description In vitro binding affinity was determined against serotonin reuptake site of rat in presence of [3H]paroxetine radioligand				J Med Chem 44: 787-805 (2001) Article DOI: 10.1021/jm001040g BindingDB Entry DOI: 10.7270/Q2JQ13R9
					More data for this Ligand-Target Pair
Monoamine transporters; Norepininephrine & dopamine (Rattus norvegicus)	BDBM50473568 (CHEMBL354112) Show SMILES C[C@@]1(C[C@H]2CN=CN2)CCc2ccccc2C1 |c:5| Show InChI InChI=1S/C15H20N2/c1-15(9-14-10-16-11-17-14)7-6-12-4-2-3-5-13(12)8-15/h2-5,11,14H,6-10H2,1H3,(H,16,17)/t14-,15+/m0/s1	Reactome pathway KEGG UniProtKB/TrEMBL GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	63	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Institut de Recherches Servier Curated by PDSP Ki Database					Assay Description In vitro binding affinity was determined against NA (noradrenaline) reuptake site of rat in presence of [3H]nisoxetine radioligand				J Med Chem 44: 787-805 (2001) Article DOI: 10.1021/jm001040g BindingDB Entry DOI: 10.7270/Q2JQ13R9
					More data for this Ligand-Target Pair
Adrenergic receptor alpha-2 (RAT-NEONATAL RAT-Rattus norvegicus (rat))	BDBM50473568 (CHEMBL354112) Show SMILES C[C@@]1(C[C@H]2CN=CN2)CCc2ccccc2C1 |c:5| Show InChI InChI=1S/C15H20N2/c1-15(9-14-10-16-11-17-14)7-6-12-4-2-3-5-13(12)8-15/h2-5,11,14H,6-10H2,1H3,(H,16,17)/t14-,15+/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	251	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Institut de Recherches Servier Curated by PDSP Ki Database					Assay Description In vitro binding affinity against alpha-2 adrenergic receptor of rat in presence of [3H]-RX 821002 radioligand				J Med Chem 44: 787-805 (2001) Article DOI: 10.1021/jm001040g BindingDB Entry DOI: 10.7270/Q2JQ13R9
					More data for this Ligand-Target Pair
Alpha-1 Adrenergic Receptor/ adrenergic receptor/ adrenergic receptor (Rattus norvegicus (rat)-Rattus norvegicus (Rat))	BDBM50473568 (CHEMBL354112) Show SMILES C[C@@]1(C[C@H]2CN=CN2)CCc2ccccc2C1 |c:5| Show InChI InChI=1S/C15H20N2/c1-15(9-14-10-16-11-17-14)7-6-12-4-2-3-5-13(12)8-15/h2-5,11,14H,6-10H2,1H3,(H,16,17)/t14-,15+/m0/s1	Reactome pathway KEGG UniProtKB/SwissProt DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	2.00E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Institut de Recherches Servier Curated by PDSP Ki Database					Assay Description In vitro binding affinity against alpha-1 adrenergic receptor of rat in presence of [3H]-prazosin radioligand				J Med Chem 44: 787-805 (2001) Article DOI: 10.1021/jm001040g BindingDB Entry DOI: 10.7270/Q2JQ13R9
					More data for this Ligand-Target Pair