BindingDB PrimarySearch_ki

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Enter Data

null

SMILES: COc1ccc(NC(=O)[C@H]2SCCNC2=O)cc1

InChI Key:

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 6 hits for monomerid = 50550043
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
Dual specificity mitogen-activated protein kinase kinase 1 (Homo sapiens (Human))	BDBM50550043 (CHEMBL4795273) Show SMILES COc1ccc(NC(=O)[C@H]2SCCNC2=O)cc1 \|r\| Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	660	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Binding affinity to full length biotinylated 6His/Avi-tagged/Tev-fused human MEK1 expressed in Escherichia coli in absence of AMP-PNP by SPR assay				Citation and Details Article DOI: 10.1021/acsmedchemlett.0c00563 BindingDB Entry DOI: 10.7270/Q2PZ5DF5
TBA					More data for this Ligand-Target Pair
Retinal rod rhodopsin-sensitive cGMP 3',5'-cyclic phosphodiesterase subunit delta (Homo sapiens (Human))	BDBM50550043 (CHEMBL4795273) Show SMILES COc1ccc(NC(=O)[C@H]2SCCNC2=O)cc1 \|r\| Show InChI	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of PDE (unknown origin)				Citation and Details Article DOI: 10.1021/acsmedchemlett.0c00563 BindingDB Entry DOI: 10.7270/Q2PZ5DF5
TBA					More data for this Ligand-Target Pair
Dual specificity mitogen-activated protein kinase kinase 1 (Homo sapiens (Human))	BDBM50550043 (CHEMBL4795273) Show SMILES COc1ccc(NC(=O)[C@H]2SCCNC2=O)cc1 \|r\| Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	330	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Binding affinity to full length biotinylated 6His/Avi-tagged/Tev-fused human MEK1 expressed in Escherichia coli in presence of AMP-PNP by SPR assay				Citation and Details Article DOI: 10.1021/acsmedchemlett.0c00563 BindingDB Entry DOI: 10.7270/Q2PZ5DF5
TBA					More data for this Ligand-Target Pair
Cytochrome c oxidase subunit 2 (Homo sapiens (Human))	BDBM50550043 (CHEMBL4795273) Show SMILES COc1ccc(NC(=O)[C@H]2SCCNC2=O)cc1 \|r\| Show InChI	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of COX2 (unknown origin)				Citation and Details Article DOI: 10.1021/acsmedchemlett.0c00563 BindingDB Entry DOI: 10.7270/Q2PZ5DF5
TBA					More data for this Ligand-Target Pair
1,3-beta-glucan synthase component GSC2 (Saccharomyces cerevisiae)	BDBM50550043 (CHEMBL4795273) Show SMILES COc1ccc(NC(=O)[C@H]2SCCNC2=O)cc1 \|r\| Show InChI	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	>4.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of human ERG				Citation and Details Article DOI: 10.1021/acsmedchemlett.0c00563 BindingDB Entry DOI: 10.7270/Q2PZ5DF5
TBA					More data for this Ligand-Target Pair
Insulin receptor (Homo sapiens (Human))	BDBM50550043 (CHEMBL4795273) Show SMILES COc1ccc(NC(=O)[C@H]2SCCNC2=O)cc1 \|r\| Show InChI	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of INSR (unknown origin)				Citation and Details Article DOI: 10.1021/acsmedchemlett.0c00563 BindingDB Entry DOI: 10.7270/Q2PZ5DF5
TBA					More data for this Ligand-Target Pair