BDBM50391431 CHEMBL2146517::acs.jmedchem.1c00409_ST.502

SMILES: COC(=O)[C@@]1(C)CCCc2c1ccc1-c3occ(C)c3C(=O)C(=O)c21

InChI Key: InChIKey=YFDKIHAZVQFLRC-UHFFFAOYSA-N

Data: 2 KI  6 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 8 hits for monomerid = 50391431   

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
Endothelial PAS domain-containing protein 1/Hypoxia-inducible factor 1-alpha (Human)	BDBM50391431 (CHEMBL2146517 | acs.jmedchem.1c00409_ST.502) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	7.48E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Endothelial PAS domain-containing protein 1/Hypoxia-inducible factor 1-alpha (Human)	BDBM50391431 (CHEMBL2146517 | acs.jmedchem.1c00409_ST.502) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	7.34E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Replicase polyprotein 1a (SARS-CoV)	BDBM50391431 (CHEMBL2146517 | acs.jmedchem.1c00409_ST.502) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	2.11E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Replicase polyprotein 1a (SARS-CoV)	BDBM50391431 (CHEMBL2146517 | acs.jmedchem.1c00409_ST.502) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	9.20E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Replicase polyprotein 1a (SARS-CoV)	BDBM50391431 (CHEMBL2146517 | acs.jmedchem.1c00409_ST.502) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1.06E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Histone-lysine N-methyltransferase EZH2/Polycomb protein EED/Polycomb protein SUZ12 (Human)	BDBM50391431 (CHEMBL2146517 | acs.jmedchem.1c00409_ST.502) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	9.60E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Replicase polyprotein 1ab (SARS-CoV)	BDBM50391431 (CHEMBL2146517 | acs.jmedchem.1c00409_ST.502) Show SMILES Show InChI	GoogleScholar	UniChem		9.70E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Replicase polyprotein 1a (SARS-CoV)	BDBM50391431 (CHEMBL2146517 | acs.jmedchem.1c00409_ST.502) Show SMILES Show InChI	GoogleScholar	UniChem		9.70E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair