BDBM50056904 3,8-Dihydroxy-11-oxo-1-(2-oxo-heptyl)-6-pentyl-11H-dibenzo[b,e][1,4]dioxepine-7-carboxylic acid::CHEMBL171637::NSC-685589::Physodic acid, 5::cid_65751::physodic acid

SMILES: CCCCCC(=O)Cc1cc(O)cc2Oc3c(OC(=O)c12)cc(O)c(C(O)=O)c3CCCCC

InChI Key: InChIKey=KVTYWHGIZSCFLG-UHFFFAOYSA-N

Data: 10 IC50  4 EC50

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 14 hits for monomerid = 50056904   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Solute carrier family 12 member 5 (Human)	BDBM50056904 (cid_65751 | 3,8-Dihydroxy-11-oxo-1-(2-oxo-heptyl)-...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	n/a	4.02E+3	n/a	n/a	n/a	n/a
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Solute carrier family 12 member 5 (Human)	BDBM50056904 (cid_65751 | 3,8-Dihydroxy-11-oxo-1-(2-oxo-heptyl)-...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	n/a	8.58E+3	n/a	n/a	n/a	n/a
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Solute carrier family 12 member 5 (Human)	BDBM50056904 (cid_65751 | 3,8-Dihydroxy-11-oxo-1-(2-oxo-heptyl)-...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	n/a	8.19E+3	n/a	n/a	n/a	n/a
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Streptokinase A (Streptococcus pyogenes M1 GAS)	BDBM50056904 (cid_65751 | 3,8-Dihydroxy-11-oxo-1-(2-oxo-heptyl)-...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	n/a	1.59E+4	n/a	n/a	n/a	n/a
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Dual specificity mitogen-activated protein kinase kinase 6 (Human)	BDBM50056904 (cid_65751 | 3,8-Dihydroxy-11-oxo-1-(2-oxo-heptyl)-...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	>2.50E+5	n/a	n/a	n/a	n/a	n/a	n/a
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Integrase (Human immunodeficiency virus type 1)	BDBM50056904 (cid_65751 | 3,8-Dihydroxy-11-oxo-1-(2-oxo-heptyl)-...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	3.85E+4	n/a	n/a	n/a	n/a	n/a	n/a
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Integrase (Human immunodeficiency virus type 1)	BDBM50056904 (cid_65751 | 3,8-Dihydroxy-11-oxo-1-(2-oxo-heptyl)-...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	3.25E+4	n/a	n/a	n/a	n/a	n/a	n/a
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Integrase (Human immunodeficiency virus type 1)	BDBM50056904 (cid_65751 | 3,8-Dihydroxy-11-oxo-1-(2-oxo-heptyl)-...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	3.09E+4	n/a	n/a	n/a	n/a	n/a	n/a
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Kinesin-like protein KIF20B (Human)	BDBM50056904 (cid_65751 | 3,8-Dihydroxy-11-oxo-1-(2-oxo-heptyl)-...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	9.90E+3	n/a	n/a	n/a	n/a	n/a	n/a
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Kinesin-like protein KIF20B (Human)	BDBM50056904 (cid_65751 | 3,8-Dihydroxy-11-oxo-1-(2-oxo-heptyl)-...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	5.80E+3	n/a	n/a	n/a	n/a	n/a	n/a
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Kinesin-like protein KIF20B (Human)	BDBM50056904 (cid_65751 | 3,8-Dihydroxy-11-oxo-1-(2-oxo-heptyl)-...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	4.60E+3	n/a	n/a	n/a	n/a	n/a	n/a
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Centromere-associated protein E (Human)	BDBM50056904 (cid_65751 | 3,8-Dihydroxy-11-oxo-1-(2-oxo-heptyl)-...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	9.14E+4	n/a	n/a	n/a	n/a	n/a	n/a
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Centromere-associated protein E (Human)	BDBM50056904 (cid_65751 | 3,8-Dihydroxy-11-oxo-1-(2-oxo-heptyl)-...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	2.96E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Kinesin-like protein KIF20B (Human)	BDBM50056904 (cid_65751 | 3,8-Dihydroxy-11-oxo-1-(2-oxo-heptyl)-...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1.04E+4	n/a	n/a	n/a	n/a	n/a	n/a
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