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BDBM50121180 5'-(3-chlorophenyl)spiro[cyclohexane-1,3'-indol]-2'(1'H)-one::CHEMBL324115

SMILES: Clc1cccc(c1)-c1ccc2NC(=O)C3(CCCCC3)c2c1

InChI Key: InChIKey=XVGXCHRWZFIARX-UHFFFAOYSA-N

Data: 3 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 3 hits for monomerid = 50121180   
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))
BDBM50121180
PNG
(5'-(3-chlorophenyl)spiro[cyclohexane-1,3'-indol]-2...)
Show SMILES Clc1cccc(c1)-c1ccc2NC(=O)C3(CCCCC3)c2c1
Show InChI InChI=1S/C19H18ClNO/c20-15-6-4-5-13(11-15)14-7-8-17-16(12-14)19(18(22)21-17)9-2-1-3-10-19/h4-8,11-12H,1-3,9-10H2,(H,21,22)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
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CHEMBL
PC cid
PC sid
UniChem

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Similars

PubMed
n/an/a 56n/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Progesterone receptor antagonist activity based on its ability to block progesterone induced alkaline phosphatase in the human breast cancer cell lin...


Bioorg Med Chem Lett 12: 3487-90 (2002)


BindingDB Entry DOI: 10.7270/Q2R210RC
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM50121180
PNG
(5'-(3-chlorophenyl)spiro[cyclohexane-1,3'-indol]-2...)
Show SMILES Clc1cccc(c1)-c1ccc2NC(=O)C3(CCCCC3)c2c1
Show InChI InChI=1S/C19H18ClNO/c20-15-6-4-5-13(11-15)14-7-8-17-16(12-14)19(18(22)21-17)9-2-1-3-10-19/h4-8,11-12H,1-3,9-10H2,(H,21,22)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

PubMed
n/an/a 477n/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Inhibition of 3 nM [3H]-R5020 binding to progesterone receptor of human T47D cell cytosol


Bioorg Med Chem Lett 12: 3487-90 (2002)


BindingDB Entry DOI: 10.7270/Q2R210RC
More data for this
Ligand-Target Pair
Progesterone receptor


(Homo sapiens (Human))
BDBM50121180
PNG
(5'-(3-chlorophenyl)spiro[cyclohexane-1,3'-indol]-2...)
Show SMILES Clc1cccc(c1)-c1ccc2NC(=O)C3(CCCCC3)c2c1
Show InChI InChI=1S/C19H18ClNO/c20-15-6-4-5-13(11-15)14-7-8-17-16(12-14)19(18(22)21-17)9-2-1-3-10-19/h4-8,11-12H,1-3,9-10H2,(H,21,22)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

PubMed
n/an/a 56n/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Inhibitory activity against progesterone receptor induced alkaline phosphatase activity in human T47D breast carcinoma cells


Bioorg Med Chem Lett 13: 1317-20 (2003)


BindingDB Entry DOI: 10.7270/Q2WS8SNP
More data for this
Ligand-Target Pair