BDBM81945 CAS_39484::CHEMBL105891::CHEMBL108926::CHEMBL271379::MPP+::NSC_39484

SMILES: C[n+]1ccc(cc1)-c1ccccc1

InChI Key: InChIKey=FMGYKKMPNATWHP-UHFFFAOYSA-N

Data: 12 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 12 hits for monomerid = 81945   

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 dopamine transporter (Rattus norvegicus (rat))	BDBM81945 (CAS_39484 | CHEMBL105891 | CHEMBL108926 | CHEMBL27...) Show SMILES C[n+]1ccc(cc1)-c1ccccc1 Show InChI InChI=1S/C12H12N/c1-13-9-7-12(8-10-13)11-5-3-2-4-6-11/h2-10H,1H3/q+1	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL MCE KEGG PC cid PC sid UniChem Patents Similars	Article PubMed	400	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Novo Industri A/S Curated by PDSP Ki Database									Eur J Pharmacol 166: 493-504 (1989) Article DOI: 10.1016/0014-2999(89)90363-4 BindingDB Entry DOI: 10.7270/Q28C9TR3
					More data for this Ligand-Target Pair
Sodium-dependent noradrenaline transporter (Homo sapiens (Human))	BDBM81945 (CAS_39484 | CHEMBL105891 | CHEMBL108926 | CHEMBL27...) Show SMILES C[n+]1ccc(cc1)-c1ccccc1 Show InChI InChI=1S/C12H12N/c1-13-9-7-12(8-10-13)11-5-3-2-4-6-11/h2-10H,1H3/q+1	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE KEGG PC cid PC sid UniChem Patents Similars	PubMed	507	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
The University of Queensland Curated by PDSP Ki Database									J Pharmacol Exp Ther 290: 761-7 (1999) BindingDB Entry DOI: 10.7270/Q2HH6HNF
					More data for this Ligand-Target Pair
Sodium-dependent noradrenaline transporter (BOVINE)	BDBM81945 (CAS_39484 | CHEMBL105891 | CHEMBL108926 | CHEMBL27...) Show SMILES C[n+]1ccc(cc1)-c1ccccc1 Show InChI InChI=1S/C12H12N/c1-13-9-7-12(8-10-13)11-5-3-2-4-6-11/h2-10H,1H3/q+1	KEGG UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL MCE KEGG PC cid PC sid UniChem Patents Similars	PubMed	570	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
The University of Queensland Curated by PDSP Ki Database									J Pharmacol Exp Ther 290: 761-7 (1999) BindingDB Entry DOI: 10.7270/Q2HH6HNF
					More data for this Ligand-Target Pair
Norepinephrine transporter (RAT)	BDBM81945 (CAS_39484 | CHEMBL105891 | CHEMBL108926 | CHEMBL27...) Show SMILES C[n+]1ccc(cc1)-c1ccccc1 Show InChI InChI=1S/C12H12N/c1-13-9-7-12(8-10-13)11-5-3-2-4-6-11/h2-10H,1H3/q+1	UniProtKB/TrEMBL GoogleScholar AffyNet	Purchase CHEMBL MCE KEGG PC cid PC sid UniChem Patents Similars	PubMed	778	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
The University of Queensland Curated by PDSP Ki Database									J Pharmacol Exp Ther 290: 761-7 (1999) BindingDB Entry DOI: 10.7270/Q2HH6HNF
					More data for this Ligand-Target Pair
Solute carrier family 22 member 1 (RAT)	BDBM81945 (CAS_39484 | CHEMBL105891 | CHEMBL108926 | CHEMBL27...) Show SMILES C[n+]1ccc(cc1)-c1ccccc1 Show InChI InChI=1S/C12H12N/c1-13-9-7-12(8-10-13)11-5-3-2-4-6-11/h2-10H,1H3/q+1	UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL MCE KEGG PC cid PC sid UniChem Patents Similars	PubMed	800	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Kyoto University Hospital Curated by ChEMBL					Assay Description TP_TRANSPORTER: inhibition of TEA uptake (basolateral to cell) in OCT1-expressing MDCK cells				J Pharmacol Exp Ther 287: 800-5 (1998) BindingDB Entry DOI: 10.7270/Q2D79CQ4
					More data for this Ligand-Target Pair
Solute carrier family 22 member 2 (RAT)	BDBM81945 (CAS_39484 | CHEMBL105891 | CHEMBL108926 | CHEMBL27...) Show SMILES C[n+]1ccc(cc1)-c1ccccc1 Show InChI InChI=1S/C12H12N/c1-13-9-7-12(8-10-13)11-5-3-2-4-6-11/h2-10H,1H3/q+1	UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL MCE KEGG PC cid PC sid UniChem Patents Similars	PubMed	1.80E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Kyoto University Hospital Curated by ChEMBL					Assay Description TP_TRANSPORTER: inhibition of TEA uptake (basolateral to cell) in OCT2-expressing MDCK cells				J Pharmacol Exp Ther 287: 800-5 (1998) BindingDB Entry DOI: 10.7270/Q2D79CQ4
					More data for this Ligand-Target Pair
Solute carrier family 22 member 2 (Homo sapiens (Human))	BDBM81945 (CAS_39484 | CHEMBL105891 | CHEMBL108926 | CHEMBL27...) Show SMILES C[n+]1ccc(cc1)-c1ccccc1 Show InChI InChI=1S/C12H12N/c1-13-9-7-12(8-10-13)11-5-3-2-4-6-11/h2-10H,1H3/q+1	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE KEGG PC cid PC sid UniChem Patents Similars	Article PubMed	2.40E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Anatomisches Institut der Bayerischen Julius-Maximilians-Universit£t Curated by ChEMBL					Assay Description TP_TRANSPORTER: inhibition of TEA uptake in Xenopus laevis oocytes				DNA Cell Biol 16: 871-81 (1997) Article DOI: 10.1089/dna.1997.16.871 BindingDB Entry DOI: 10.7270/Q2R2148R
					More data for this Ligand-Target Pair
Solute carrier family 22 member 1 (Homo sapiens (Human))	BDBM81945 (CAS_39484 | CHEMBL105891 | CHEMBL108926 | CHEMBL27...) Show SMILES C[n+]1ccc(cc1)-c1ccccc1 Show InChI InChI=1S/C12H12N/c1-13-9-7-12(8-10-13)11-5-3-2-4-6-11/h2-10H,1H3/q+1	UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE KEGG PC cid PC sid UniChem Patents Similars	PubMed	1.23E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of California Curated by ChEMBL					Assay Description TP_TRANSPORTER: inhibition of TEA uptake in OCT1-expressing HeLa cells				J Pharmacol Exp Ther 286: 354-61 (1998) BindingDB Entry DOI: 10.7270/Q28P63DW
					More data for this Ligand-Target Pair
Solute carrier family 22 member 1 (RAT)	BDBM81945 (CAS_39484 | CHEMBL105891 | CHEMBL108926 | CHEMBL27...) Show SMILES C[n+]1ccc(cc1)-c1ccccc1 Show InChI InChI=1S/C12H12N/c1-13-9-7-12(8-10-13)11-5-3-2-4-6-11/h2-10H,1H3/q+1	UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL MCE KEGG PC cid PC sid UniChem Patents Similars	Article PubMed	1.30E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Bayerische Julius-Maximilians-Universit£t Curated by ChEMBL					Assay Description TP_TRANSPORTER: inhibition of TEA uptake in Xenopus laevis oocytes				Nature 372: 549-552 (1994) Article DOI: 10.1038/372549a0 BindingDB Entry DOI: 10.7270/Q2B56M05
					More data for this Ligand-Target Pair
Sodium-dependent serotonin transporter (Homo sapiens (Human))	BDBM81945 (CAS_39484 | CHEMBL105891 | CHEMBL108926 | CHEMBL27...) Show SMILES C[n+]1ccc(cc1)-c1ccccc1 Show InChI InChI=1S/C12H12N/c1-13-9-7-12(8-10-13)11-5-3-2-4-6-11/h2-10H,1H3/q+1	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE KEGG PC cid PC sid UniChem Patents Similars	Article PubMed	4.80E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Purdue University Curated by ChEMBL					Assay Description Inhibition of [3H]5-HT uptake at human SERT C109A mutant transfected in HEK cells				Bioorg Med Chem 15: 305-11 (2007) Article DOI: 10.1016/j.bmc.2006.09.058 BindingDB Entry DOI: 10.7270/Q2DV1NNQ
					More data for this Ligand-Target Pair
Solute carrier family 22 member 3 (Homo sapiens (Human))	BDBM81945 (CAS_39484 | CHEMBL105891 | CHEMBL108926 | CHEMBL27...) Show SMILES C[n+]1ccc(cc1)-c1ccccc1 Show InChI InChI=1S/C12H12N/c1-13-9-7-12(8-10-13)11-5-3-2-4-6-11/h2-10H,1H3/q+1	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE KEGG PC cid PC sid UniChem Patents Similars	Article PubMed	5.40E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Medical College of Georgia Curated by ChEMBL					Assay Description TP_TRANSPORTER: inhibition of MPP+ uptake in OCT3-expressing HRPE cells				Am J Physiol Renal Physiol 279: 449-58 (2000) Article DOI: 10.1152/ajprenal.2000.279.3.f449 BindingDB Entry DOI: 10.7270/Q2708482
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Synaptic vesicular amine transporter (Bos taurus)	BDBM81945 (CAS_39484 | CHEMBL105891 | CHEMBL108926 | CHEMBL27...) Show SMILES C[n+]1ccc(cc1)-c1ccccc1 Show InChI InChI=1S/C12H12N/c1-13-9-7-12(8-10-13)11-5-3-2-4-6-11/h2-10H,1H3/q+1	KEGG UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL MCE KEGG PC cid PC sid UniChem Patents Similars	Article PubMed	9.20E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Wichita State University Curated by ChEMBL					Assay Description Inhibition of dopamine uptake at VMAT in bovine chromaffin granule ghosts				J Med Chem 51: 760-8 (2008) Article DOI: 10.1021/jm070875p BindingDB Entry DOI: 10.7270/Q2M909J6
					More data for this Ligand-Target Pair