BDBM100261 MLS002702133::SMR001565698::cid_431377

SMILES: [H]C12CC3OC(=O)C=CC=CC(=O)OCCC(C)C(OC(C)=O)C(=O)OCC4(CCC5(C)OC5C4O1)C3(C)C21CO1

InChI Key: InChIKey=JDFKYDYICWYZMF-UHFFFAOYSA-N

Data: 2 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 2 hits for monomerid = 100261   

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
Alpha trans-inducing protein (VP16) (Human herpesvirus 1 (strain 17) (HHV-1) (Human her...)	BDBM100261 (MLS002702133 | SMR001565698 | cid_431377) Show SMILES [H]C12CC3OC(=O)C=CC=CC(=O)OCCC(C)C(OC(C)=O)C(=O)OCC4(CCC5(C)OC5C4O1)C3(C)C21CO1 |TLB:33:34:38:3.2,28:27:38:3.2,26:27:38:3.2,THB:40:38:35.27.34:3.2,4:3:38:35.27.34,39:38:35.27.34:3.2| Show InChI InChI=1S/C29H36O11/c1-16-9-12-34-20(31)7-5-6-8-21(32)38-18-13-19-29(15-36-29)27(18,4)28(14-35-25(33)22(16)37-17(2)30)11-10-26(3)23(40-26)24(28)39-19/h5-8,16,18-19,22-24H,9-15H2,1-4H3	MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	8.55E+4	n/a	n/a	n/a	n/a	n/a	n/a
The Scripps Research Institute Molecular Screening Center Curated by PubChem BioAssay					Assay Description Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center Affiliation: The Scripps Research Institute, TSRI Assay Provide...				PubChem Bioassay (2013) BindingDB Entry DOI: 10.7270/Q2GM85ZT
					More data for this Ligand-Target Pair
COUP transcription factor 2 isoform a (Homo sapiens (Human))	BDBM100261 (MLS002702133 | SMR001565698 | cid_431377) Show SMILES [H]C12CC3OC(=O)C=CC=CC(=O)OCCC(C)C(OC(C)=O)C(=O)OCC4(CCC5(C)OC5C4O1)C3(C)C21CO1 |TLB:33:34:38:3.2,28:27:38:3.2,26:27:38:3.2,THB:40:38:35.27.34:3.2,4:3:38:35.27.34,39:38:35.27.34:3.2| Show InChI InChI=1S/C29H36O11/c1-16-9-12-34-20(31)7-5-6-8-21(32)38-18-13-19-29(15-36-29)27(18,4)28(14-35-25(33)22(16)37-17(2)30)11-10-26(3)23(40-26)24(28)39-19/h5-8,16,18-19,22-24H,9-15H2,1-4H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	7.64	n/a	n/a	n/a	n/a	n/a	n/a
The Scripps Research Institute Molecular Screening Center Curated by PubChem BioAssay									PubChem Bioassay (2013) BindingDB Entry DOI: 10.7270/Q21Z431S
					More data for this Ligand-Target Pair