BindingDB PrimarySearch

BDBM50420185 CHEMBL1233636

SMILES: OS(=O)(=O)Oc1c[nH]c2ccccc12

InChI Key: InChIKey=BXFFHSIDQOFMLE-UHFFFAOYSA-N

Data: 6 KI 1 IC50 1 Kd

PDB links: 2 PDB IDs match this monomer.

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 8 hits for monomerid = 50420185
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
Solute carrier family 22 member 6 (Homo sapiens (Human))	BDBM50420185 (CHEMBL1233636) Show SMILES OS(=O)(=O)Oc1c[nH]c2ccccc12 Show InChI	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE KEGG MMDB PC cid PC sid PDB UniChem Similars	PubMed	2.27E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Nagoya University School of Medicine Curated by ChEMBL					Assay Description TP_TRANSPORTER: inhibition of PAH uptake (PAH: 5 uM, indoxyl sulfate:500 uM) in S2 human-OAT1 expressing cells				Eur J Pharmacol 466: 13-20 (2003) BindingDB Entry DOI: 10.7270/Q23R0V48
Nagoya University School of Medicine Curated by ChEMBL					More data for this Ligand-Target Pair
Solute carrier family 22 member 6 (Homo sapiens (Human))	BDBM50420185 (CHEMBL1233636) Show SMILES OS(=O)(=O)Oc1c[nH]c2ccccc12 Show InChI	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE KEGG MMDB PC cid PC sid PDB UniChem Similars	PubMed	2.30E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Nagoya University School of Medicine Curated by ChEMBL					Assay Description TP_TRANSPORTER: uptake&inhibition of PAH in OAT1-S2 cells				Eur J Pharmacol 466: 13-20 (2003) BindingDB Entry DOI: 10.7270/Q23R0V48
Nagoya University School of Medicine Curated by ChEMBL					More data for this Ligand-Target Pair
Solute carrier family 22 member 8 (Homo sapiens (Human))	BDBM50420185 (CHEMBL1233636) Show SMILES OS(=O)(=O)Oc1c[nH]c2ccccc12 Show InChI	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE KEGG MMDB PC cid PC sid PDB UniChem Similars	PubMed	1.69E+5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Nagoya University School of Medicine Curated by ChEMBL					Assay Description TP_TRANSPORTER: inhibition of E1S uptake (E1S: 5 uM, indoxyl sulfate:500 uM) in S2 cells expressing human-OAT3				Eur J Pharmacol 466: 13-20 (2003) BindingDB Entry DOI: 10.7270/Q23R0V48
Nagoya University School of Medicine Curated by ChEMBL					More data for this Ligand-Target Pair
Solute carrier family 22 member 8 (Homo sapiens (Human))	BDBM50420185 (CHEMBL1233636) Show SMILES OS(=O)(=O)Oc1c[nH]c2ccccc12 Show InChI	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE KEGG MMDB PC cid PC sid PDB UniChem Similars	PubMed	1.69E+5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Nagoya University School of Medicine Curated by ChEMBL					Assay Description TP_TRANSPORTER: uptake&inhibition of estrone sulfate in OAT3-S2 cells				Eur J Pharmacol 466: 13-20 (2003) BindingDB Entry DOI: 10.7270/Q23R0V48
Nagoya University School of Medicine Curated by ChEMBL					More data for this Ligand-Target Pair
Solute carrier family 22 member 11 (Homo sapiens (Human))	BDBM50420185 (CHEMBL1233636) Show SMILES OS(=O)(=O)Oc1c[nH]c2ccccc12 Show InChI	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE KEGG MMDB PC cid PC sid PDB UniChem Similars	PubMed	1.81E+5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Nagoya University School of Medicine Curated by ChEMBL					Assay Description TP_TRANSPORTER: uptake&inhibition of estrone sulfate in OAT4-S2 cells				Eur J Pharmacol 466: 13-20 (2003) BindingDB Entry DOI: 10.7270/Q23R0V48
Nagoya University School of Medicine Curated by ChEMBL					More data for this Ligand-Target Pair
Solute carrier family 22 member 11 (Homo sapiens (Human))	BDBM50420185 (CHEMBL1233636) Show SMILES OS(=O)(=O)Oc1c[nH]c2ccccc12 Show InChI	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE KEGG MMDB PC cid PC sid PDB UniChem Similars	PubMed	1.81E+5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Nagoya University School of Medicine Curated by ChEMBL					Assay Description TP_TRANSPORTER: inhibition of E1S uptake (E1S: 5 uM, indoxyl sulfate:500 uM) in S2 cells expressing human-OAT4				Eur J Pharmacol 466: 13-20 (2003) BindingDB Entry DOI: 10.7270/Q23R0V48
Nagoya University School of Medicine Curated by ChEMBL					More data for this Ligand-Target Pair
Serum albumin (Bos taurus)	BDBM50420185 (CHEMBL1233636) Show SMILES OS(=O)(=O)Oc1c[nH]c2ccccc12 Show InChI	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE KEGG MMDB PC cid PC sid PDB UniChem Similars	Article PubMed	n/a	n/a	n/a	3.00E+4	n/a	n/a	n/a	n/a	n/a
University of Innsbruck Curated by ChEMBL					Assay Description Binding affinity to BSA assessed as binding constant at 1H-2 resonance by (1)H relaxation dispersion NMR spectroscopy				J Med Chem 59: 10788-10793 (2016) Article DOI: 10.1021/acs.jmedchem.6b01110 BindingDB Entry DOI: 10.7270/Q28W3G8K
University of Innsbruck Curated by ChEMBL					More data for this Ligand-Target Pair
Solute carrier family 22 member 6 (Homo sapiens (Human))	BDBM50420185 (CHEMBL1233636) Show SMILES OS(=O)(=O)Oc1c[nH]c2ccccc12 Show InChI	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE KEGG MMDB PC cid PC sid PDB UniChem Similars	Article PubMed	n/a	n/a	8.30E+4	n/a	n/a	n/a	n/a	n/a	n/a
Tokyo Women's Medical University Curated by ChEMBL					Assay Description TP_TRANSPORTER: inhibition of PAH uptake in OAT-expressing OK cells				Br J Pharmacol 135: 555-63 (2002) Article DOI: 10.1038/sj.bjp.0704482 BindingDB Entry DOI: 10.7270/Q21J9C29
Tokyo Women's Medical University Curated by ChEMBL					More data for this Ligand-Target Pair