null

SMILES: CO[C@H]1C[C@H](C)Cc2c(O)c(NC(=O)C(C)=CC=C[C@H](OC)[C@@H](OC(N)=O)\C(C)=C\[C@H](C)[C@H]1O)cc(O)c2N=CCCOc1ccc2c(c1)oc(cc2=O)N1CCOCC1

InChI Key: InChIKey=UVUOQMGBRGTLIR-OOEGKZEGSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50098116   

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))	BDBM50098116 (CHEMBL173928 | Carbamic acid 13-hydroxy-8,14-dimet...) Show SMILES CO[C@H]1C[C@H](C)Cc2c(O)c(NC(=O)C(C)=CC=C[C@H](OC)[C@@H](OC(N)=O)\C(C)=C\[C@H](C)[C@H]1O)cc(O)c2N=CCCOc1ccc2c(c1)oc(cc2=O)N1CCOCC1 |w:16.16,39.41,t:28| Show InChI InChI=1S/C44H56N4O12/c1-25-19-31-39(46-13-8-16-58-29-11-12-30-33(49)24-38(59-36(30)22-29)48-14-17-57-18-15-48)34(50)23-32(41(31)52)47-43(53)26(2)9-7-10-35(55-5)42(60-44(45)54)28(4)21-27(3)40(51)37(20-25)56-6/h7,9-13,21-25,27,35,37,40,42,50-52H,8,14-20H2,1-6H3,(H2,45,54)(H,47,53)/b10-7?,26-9?,28-21+,46-13?/t25-,27+,35+,37+,40-,42+/m1/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	n/a	n/a	2.60E+4	n/a	n/a	n/a	n/a
Department of Molecular Oncogenesis Curated by ChEMBL					Assay Description Competitive binding towards Heat shock protein HSP 90-alpha				Bioorg Med Chem Lett 11: 909-13 (2001) BindingDB Entry DOI: 10.7270/Q2NV9HJX
					More data for this Ligand-Target Pair
DNA-dependent protein kinase catalytic subunit (Homo sapiens (Human))	BDBM50098116 (CHEMBL173928 | Carbamic acid 13-hydroxy-8,14-dimet...) Show SMILES CO[C@H]1C[C@H](C)Cc2c(O)c(NC(=O)C(C)=CC=C[C@H](OC)[C@@H](OC(N)=O)\C(C)=C\[C@H](C)[C@H]1O)cc(O)c2N=CCCOc1ccc2c(c1)oc(cc2=O)N1CCOCC1 |w:16.16,39.41,t:28| Show InChI InChI=1S/C44H56N4O12/c1-25-19-31-39(46-13-8-16-58-29-11-12-30-33(49)24-38(59-36(30)22-29)48-14-17-57-18-15-48)34(50)23-32(41(31)52)47-43(53)26(2)9-7-10-35(55-5)42(60-44(45)54)28(4)21-27(3)40(51)37(20-25)56-6/h7,9-13,21-25,27,35,37,40,42,50-52H,8,14-20H2,1-6H3,(H2,45,54)(H,47,53)/b10-7?,26-9?,28-21+,46-13?/t25-,27+,35+,37+,40-,42+/m1/s1	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	2.80E+4	n/a	n/a	n/a	n/a	n/a	n/a
Department of Molecular Oncogenesis Curated by ChEMBL					Assay Description Inhibition of DNA dependent protein kinase activity without hsp90 alpha protein				Bioorg Med Chem Lett 11: 909-13 (2001) BindingDB Entry DOI: 10.7270/Q2NV9HJX
					More data for this Ligand-Target Pair