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SMILES: CC#C[C@]1(O)CC[C@H]2[C@@H]3CCC4=CC(=O)CCC4=C3[C@H](C[C@]12C)c1ccc(cc1)N(C)C(=O)NCCCCCC(=O)N[C@@H](CC(C)C)C(=O)OC(C)(C)C

InChI Key: InChIKey=VDLBUXZADLOASI-NGLNOBBASA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50292781   
Target/Host
(Institution)		LigandTarget/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		pHTemp
°C
Progesterone receptor


(Homo sapiens (Human))		BDBM50292781
PNG
(17beta-Hydroxy-11beta-{4-[1,14,14-trimethyl-11-(2-...)
Show SMILES CC#C[C@]1(O)CC[C@H]2[C@@H]3CCC4=CC(=O)CCC4=C3[C@H](C[C@]12C)c1ccc(cc1)N(C)C(=O)NCCCCCC(=O)N[C@@H](CC(C)C)C(=O)OC(C)(C)C |r,c:18,t:11|
Show InChI InChI=1S/C45H63N3O6/c1-9-23-45(53)24-22-37-35-20-16-31-27-33(49)19-21-34(31)40(35)36(28-44(37,45)7)30-14-17-32(18-15-30)48(8)42(52)46-25-12-10-11-13-39(50)47-38(26-29(2)3)41(51)54-43(4,5)6/h14-15,17-18,27,29,35-38,53H,10-13,16,19-22,24-26,28H2,1-8H3,(H,46,52)(H,47,50)/t35-,36+,37-,38-,44-,45-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

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DrugBank
antibodypedia
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PC cid
PC sid
UniChem

Similars
Article
PubMed
n/an/a 1.70n/an/an/an/an/an/a



University of Graz

Curated by ChEMBL


Assay Description
Antagonist activity at progesterone receptor in human T47D cells assessed as inhibition of progesterone-induced alkaline phosphatase activity after 4...

J Med Chem 52: 1268-74 (2010)


Article DOI: 10.1021/jm800985z
BindingDB Entry DOI: 10.7270/Q27S7PPM
More data for this
Ligand-Target Pair