BDBM87037 (S)-2-((S)-(4-chloro-2-methoxyphenoxy)(3-fluorophenyl)methyl)morpholine::CAS_44450119::NSC_44450119

SMILES: COc1cc(Cl)ccc1OC(C1CNCCO1)c1cccc(F)c1

InChI Key: InChIKey=SGXWOKUJCWMPJE-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 = 87037   

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 noradrenaline transporter (Homo sapiens (Human))	BDBM87037 ((S)-2-((S)-(4-chloro-2-methoxyphenoxy)(3-fluorophe...) Show SMILES COc1cc(Cl)ccc1OC(C1CNCCO1)c1cccc(F)c1 Show InChI InChI=1S/C18H19ClFNO3/c1-22-16-10-13(19)5-6-15(16)24-18(17-11-21-7-8-23-17)12-3-2-4-14(20)9-12/h2-6,9-10,17-18,21H,7-8,11H2,1H3	Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	9	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Global Research and Development Curated by PDSP Ki Database									Bioorg Med Chem Lett 18: 2562-6 (2008) Article DOI: 10.1016/j.bmcl.2008.03.050 BindingDB Entry DOI: 10.7270/Q2Z036RS
					More data for this Ligand-Target Pair
Sodium-dependent serotonin transporter (Homo sapiens (Human))	BDBM87037 ((S)-2-((S)-(4-chloro-2-methoxyphenoxy)(3-fluorophe...) Show SMILES COc1cc(Cl)ccc1OC(C1CNCCO1)c1cccc(F)c1 Show InChI InChI=1S/C18H19ClFNO3/c1-22-16-10-13(19)5-6-15(16)24-18(17-11-21-7-8-23-17)12-3-2-4-14(20)9-12/h2-6,9-10,17-18,21H,7-8,11H2,1H3	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	58	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Global Research and Development Curated by PDSP Ki Database									Bioorg Med Chem Lett 18: 2562-6 (2008) Article DOI: 10.1016/j.bmcl.2008.03.050 BindingDB Entry DOI: 10.7270/Q2Z036RS
					More data for this Ligand-Target Pair
Sodium-dependent dopamine transporter (Homo sapiens (Human))	BDBM87037 ((S)-2-((S)-(4-chloro-2-methoxyphenoxy)(3-fluorophe...) Show SMILES COc1cc(Cl)ccc1OC(C1CNCCO1)c1cccc(F)c1 Show InChI InChI=1S/C18H19ClFNO3/c1-22-16-10-13(19)5-6-15(16)24-18(17-11-21-7-8-23-17)12-3-2-4-14(20)9-12/h2-6,9-10,17-18,21H,7-8,11H2,1H3	NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Global Research and Development Curated by PDSP Ki Database									Bioorg Med Chem Lett 18: 2562-6 (2008) Article DOI: 10.1016/j.bmcl.2008.03.050 BindingDB Entry DOI: 10.7270/Q2Z036RS
					More data for this Ligand-Target Pair