BDBM50464551 CHEMBL4281643::US10464907, Compound 16a::US10889552, Compound 14i

SMILES: CN(Cc1ccccc1C)C(=O)c1cc(Cl)c(O)cc1O

InChI Key: InChIKey=CGZOPNOFDMEXMB-UHFFFAOYSA-N

Data: 3 IC50

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 = 50464551   

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
Heat shock protein HSP 90-alpha (Homo sapiens (Human))	BDBM50464551 (CHEMBL4281643 | US10464907, Compound 16a | US10889...) Show SMILES CN(Cc1ccccc1C)C(=O)c1cc(Cl)c(O)cc1O Show InChI InChI=1S/C16H16ClNO3/c1-10-5-3-4-6-11(10)9-18(2)16(21)12-7-13(17)15(20)8-14(12)19/h3-8,19-20H,9H2,1-2H3	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	995	n/a	n/a	n/a	n/a	n/a	n/a
Keimyung University Curated by ChEMBL					Assay Description Inhibition of FITC-geldanamycin binding to N-terminal domain of recombinant full-length HSP90alpha (unknown origin) after 16 hrs by fluorescence pola...				Eur J Med Chem 143: 390-401 (2018) Article DOI: 10.1016/j.ejmech.2017.11.054 BindingDB Entry DOI: 10.7270/Q29C713M
					More data for this Ligand-Target Pair
Heat shock protein HSP 90-alpha (Homo sapiens (Human))	BDBM50464551 (CHEMBL4281643 | US10464907, Compound 16a | US10889...) Show SMILES CN(Cc1ccccc1C)C(=O)c1cc(Cl)c(O)cc1O Show InChI InChI=1S/C16H16ClNO3/c1-10-5-3-4-6-11(10)9-18(2)16(21)12-7-13(17)15(20)8-14(12)19/h3-8,19-20H,9H2,1-2H3	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	995	n/a	n/a	n/a	n/a	n/a	n/a
ONCOZEN CO.. LTD. US Patent					Assay Description Endonuclease activity assays were carried out in Black Costar 96-well plates. Each well contained a total volume of 100 μL comprised of: buffer ...				US Patent US10889552 (2021)
					More data for this Ligand-Target Pair
Heat shock protein HSP 90-alpha (Bovine)	BDBM50464551 (CHEMBL4281643 | US10464907, Compound 16a | US10889...) Show SMILES CN(Cc1ccccc1C)C(=O)c1cc(Cl)c(O)cc1O Show InChI InChI=1S/C16H16ClNO3/c1-10-5-3-4-6-11(10)9-18(2)16(21)12-7-13(17)15(20)8-14(12)19/h3-8,19-20H,9H2,1-2H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	830	n/a	n/a	n/a	n/a	n/a	n/a
INDUSTRY ACADEMIC COOPERATION FOUNDATION KEIMYUNG UNIVERSITY US Patent					Assay Description Fluorescence polarization assay was performed to confirm the binding ability to the compound synthesized with HSP90 according the concentration. 1 M ...				US Patent US10464907 (2019) BindingDB Entry DOI: 10.7270/Q2MC92C5
					More data for this Ligand-Target Pair