BDBM50272397 (11beta,16beta)-9-Fluoro-11,21-dihydroxy-16-methyl-3,20-dioxopregna-1,4-dien-17-yl ethylcarbamate::CHEMBL500678

SMILES: CCNC(=O)O[C@@]1([C@@H](C)C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]12C)C(=O)CO

InChI Key: InChIKey=PGQPSPSQMSIFKS-XGQKBEPLSA-N

Data: 2 IC50  1 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 3 hits for monomerid = 50272397   

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
Glucocorticoid receptor (Homo sapiens (Human))	BDBM50272397 ((11beta,16beta)-9-Fluoro-11,21-dihydroxy-16-methyl...) Show SMILES CCNC(=O)O[C@@]1([C@@H](C)C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]12C)C(=O)CO |r,c:18,t:14| Show InChI InChI=1S/C25H34FNO6/c1-5-27-21(32)33-25(20(31)13-28)14(2)10-18-17-7-6-15-11-16(29)8-9-22(15,3)24(17,26)19(30)12-23(18,25)4/h8-9,11,14,17-19,28,30H,5-7,10,12-13H2,1-4H3,(H,27,32)/t14-,17-,18-,19-,22-,23-,24-,25-/m0/s1	PDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	5.10	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Inhibition of human glucocorticoid receptor				Bioorg Med Chem 16: 7535-42 (2008) Article DOI: 10.1016/j.bmc.2008.07.037 BindingDB Entry DOI: 10.7270/Q2CC10HX
					More data for this Ligand-Target Pair
Progesterone receptor (Homo sapiens (Human))	BDBM50272397 ((11beta,16beta)-9-Fluoro-11,21-dihydroxy-16-methyl...) Show SMILES CCNC(=O)O[C@@]1([C@@H](C)C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]12C)C(=O)CO |r,c:18,t:14| Show InChI InChI=1S/C25H34FNO6/c1-5-27-21(32)33-25(20(31)13-28)14(2)10-18-17-7-6-15-11-16(29)8-9-22(15,3)24(17,26)19(30)12-23(18,25)4/h8-9,11,14,17-19,28,30H,5-7,10,12-13H2,1-4H3,(H,27,32)/t14-,17-,18-,19-,22-,23-,24-,25-/m0/s1	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	>1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Inhibition of human progesterone receptor				Bioorg Med Chem 16: 7535-42 (2008) Article DOI: 10.1016/j.bmc.2008.07.037 BindingDB Entry DOI: 10.7270/Q2CC10HX
					More data for this Ligand-Target Pair
Interstitial collagenase (Homo sapiens (Human))	BDBM50272397 ((11beta,16beta)-9-Fluoro-11,21-dihydroxy-16-methyl...) Show SMILES CCNC(=O)O[C@@]1([C@@H](C)C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]12C)C(=O)CO |r,c:18,t:14| Show InChI InChI=1S/C25H34FNO6/c1-5-27-21(32)33-25(20(31)13-28)14(2)10-18-17-7-6-15-11-16(29)8-9-22(15,3)24(17,26)19(30)12-23(18,25)4/h8-9,11,14,17-19,28,30H,5-7,10,12-13H2,1-4H3,(H,27,32)/t14-,17-,18-,19-,22-,23-,24-,25-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	n/a	n/a	15.9	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Inhibition of glucocorticoid-mediated human MMP1 expression in PMA stimulated A549 cells assessed as MMP1 protein level by ELISA				Bioorg Med Chem 16: 7535-42 (2008) Article DOI: 10.1016/j.bmc.2008.07.037 BindingDB Entry DOI: 10.7270/Q2CC10HX
					More data for this Ligand-Target Pair