BindingDB logo
myBDB logout

BDBM50081446 CHEMBL91270::sulfonylurea analogue

SMILES: CCCCNC(=O)NS(=O)(=O)c1ccccc1-c1ccc(CN2c3ccccc3CCc3ccccc3C2=O)cc1

InChI Key: InChIKey=YDEUXSDMLVTWAP-UHFFFAOYSA-N

Data: 4 KI

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 4 hits for monomerid = 50081446   
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
Prostaglandin E2 receptor EP1 subtype (EP1)


(Homo sapiens (Human))
BDBM50081446
PNG
(CHEMBL91270 | sulfonylurea analogue)
Show SMILES CCCCNC(=O)NS(=O)(=O)c1ccccc1-c1ccc(CN2c3ccccc3CCc3ccccc3C2=O)cc1
Show InChI InChI=1S/C33H33N3O4S/c1-2-3-22-34-33(38)35-41(39,40)31-15-9-7-12-28(31)26-18-16-24(17-19-26)23-36-30-14-8-5-11-27(30)21-20-25-10-4-6-13-29(25)32(36)37/h4-19H,2-3,20-23H2,1H3,(H2,34,35,38)
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

PubMed
220n/an/an/an/an/an/an/an/a



Merck Frosst Centre for Therapeutic Research

Curated by ChEMBL


Assay Description
Affinity at human EP1 receptor.


Bioorg Med Chem Lett 9: 2699-704 (1999)


BindingDB Entry DOI: 10.7270/Q2HX1BV9
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor


(Homo sapiens (Human))
BDBM50081446
PNG
(CHEMBL91270 | sulfonylurea analogue)
Show SMILES CCCCNC(=O)NS(=O)(=O)c1ccccc1-c1ccc(CN2c3ccccc3CCc3ccccc3C2=O)cc1
Show InChI InChI=1S/C33H33N3O4S/c1-2-3-22-34-33(38)35-41(39,40)31-15-9-7-12-28(31)26-18-16-24(17-19-26)23-36-30-14-8-5-11-27(30)21-20-25-10-4-6-13-29(25)32(36)37/h4-19H,2-3,20-23H2,1H3,(H2,34,35,38)
PDB

KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

PubMed
6.00E+3n/an/an/an/an/an/an/an/a



Merck Frosst Centre for Therapeutic Research

Curated by ChEMBL


Assay Description
Affinity at human EP3 receptor.


Bioorg Med Chem Lett 9: 2699-704 (1999)


BindingDB Entry DOI: 10.7270/Q2HX1BV9
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor EP4 subtype


(Homo sapiens (Human))
BDBM50081446
PNG
(CHEMBL91270 | sulfonylurea analogue)
Show SMILES CCCCNC(=O)NS(=O)(=O)c1ccccc1-c1ccc(CN2c3ccccc3CCc3ccccc3C2=O)cc1
Show InChI InChI=1S/C33H33N3O4S/c1-2-3-22-34-33(38)35-41(39,40)31-15-9-7-12-28(31)26-18-16-24(17-19-26)23-36-30-14-8-5-11-27(30)21-20-25-10-4-6-13-29(25)32(36)37/h4-19H,2-3,20-23H2,1H3,(H2,34,35,38)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

PubMed
>1.00E+5n/an/an/an/an/an/an/an/a



Merck Frosst Centre for Therapeutic Research

Curated by ChEMBL


Assay Description
Affinity at human EP4 receptor.


Bioorg Med Chem Lett 9: 2699-704 (1999)


BindingDB Entry DOI: 10.7270/Q2HX1BV9
More data for this
Ligand-Target Pair
Prostaglandin E2 receptor EP2 subtype


(Homo sapiens (Human))
BDBM50081446
PNG
(CHEMBL91270 | sulfonylurea analogue)
Show SMILES CCCCNC(=O)NS(=O)(=O)c1ccccc1-c1ccc(CN2c3ccccc3CCc3ccccc3C2=O)cc1
Show InChI InChI=1S/C33H33N3O4S/c1-2-3-22-34-33(38)35-41(39,40)31-15-9-7-12-28(31)26-18-16-24(17-19-26)23-36-30-14-8-5-11-27(30)21-20-25-10-4-6-13-29(25)32(36)37/h4-19H,2-3,20-23H2,1H3,(H2,34,35,38)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

PubMed
>1.00E+5n/an/an/an/an/an/an/an/a



Merck Frosst Centre for Therapeutic Research

Curated by ChEMBL


Assay Description
Affinity at human EP2 receptor.


Bioorg Med Chem Lett 9: 2699-704 (1999)


BindingDB Entry DOI: 10.7270/Q2HX1BV9
More data for this
Ligand-Target Pair