BindingDB logo
myBDB logout

7 similar compounds to monomer 50412544

Wt: 463.5
BDBM50412542
Wt: 519.6
BDBM50412545
Wt: 505.6
BDBM50412546
Wt: 491.6
BDBM50412547
Wt: 477.5
BDBM50412548
Wt: 519.6
BDBM50412549
Wt: 505.6
BDBM50412550

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 7 hits for monomerid = 50412542,50412545,50412546,50412547,50412548,50412549,50412550   
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
AGTR1


(RAT)
BDBM50412542
PNG
(CHEMBL480017)
Show SMILES CCCCc1nc2cc(ccc2n1Cc1ccc(cc1)-c1ccccc1C(O)=O)S(N)(=O)=O
Show InChI InChI=1S/C25H25N3O4S/c1-2-3-8-24-27-22-15-19(33(26,31)32)13-14-23(22)28(24)16-17-9-11-18(12-10-17)20-6-4-5-7-21(20)25(29)30/h4-7,9-15H,2-3,8,16H2,1H3,(H,29,30)(H2,26,31,32)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/a 200n/an/an/an/an/a



Punjabi University

Curated by ChEMBL


Assay Description
Antagonist activity at AT1 receptor in rat aortic rings


Bioorg Med Chem 16: 10210-5 (2008)

More data for this
Ligand-Target Pair
AGTR1


(RAT)
BDBM50412545
PNG
(CHEMBL518388)
Show SMILES CCCCc1nc2cc(ccc2n1Cc1ccc(cc1)-c1ccccc1C(O)=O)S(=O)(=O)NC(C)(C)C
Show InChI InChI=1S/C29H33N3O4S/c1-5-6-11-27-30-25-18-22(37(35,36)31-29(2,3)4)16-17-26(25)32(27)19-20-12-14-21(15-13-20)23-9-7-8-10-24(23)28(33)34/h7-10,12-18,31H,5-6,11,19H2,1-4H3,(H,33,34)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/a 3.98n/an/an/an/an/a



Punjabi University

Curated by ChEMBL


Assay Description
Antagonist activity at AT1 receptor in rat aortic rings


Bioorg Med Chem 16: 10210-5 (2008)

More data for this
Ligand-Target Pair
AGTR1


(RAT)
BDBM50412546
PNG
(CHEMBL518230)
Show SMILES CCCCc1nc2cc(ccc2n1Cc1ccc(cc1)-c1ccccc1C(O)=O)S(=O)(=O)NC(C)C
Show InChI InChI=1S/C28H31N3O4S/c1-4-5-10-27-29-25-17-22(36(34,35)30-19(2)3)15-16-26(25)31(27)18-20-11-13-21(14-12-20)23-8-6-7-9-24(23)28(32)33/h6-9,11-17,19,30H,4-5,10,18H2,1-3H3,(H,32,33)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/a 63.1n/an/an/an/an/a



Punjabi University

Curated by ChEMBL


Assay Description
Antagonist activity at AT1 receptor in rat aortic rings


Bioorg Med Chem 16: 10210-5 (2008)

More data for this
Ligand-Target Pair
AGTR1


(RAT)
BDBM50412550
PNG
(CHEMBL479626)
Show SMILES CCCCc1nc2cc(ccc2n1Cc1ccc(cc1)-c1ccccc1C(O)=O)S(=O)(=O)NCCC
Show InChI InChI=1S/C28H31N3O4S/c1-3-5-10-27-30-25-18-22(36(34,35)29-17-4-2)15-16-26(25)31(27)19-20-11-13-21(14-12-20)23-8-6-7-9-24(23)28(32)33/h6-9,11-16,18,29H,3-5,10,17,19H2,1-2H3,(H,32,33)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/a 79.4n/an/an/an/an/a



Punjabi University

Curated by ChEMBL


Assay Description
Antagonist activity at AT1 receptor in rat aortic rings


Bioorg Med Chem 16: 10210-5 (2008)

More data for this
Ligand-Target Pair
AGTR1


(RAT)
BDBM50412548
PNG
(CHEMBL480018)
Show SMILES CCCCc1nc2cc(ccc2n1Cc1ccc(cc1)-c1ccccc1C(O)=O)S(=O)(=O)NC
Show InChI InChI=1S/C26H27N3O4S/c1-3-4-9-25-28-23-16-20(34(32,33)27-2)14-15-24(23)29(25)17-18-10-12-19(13-11-18)21-7-5-6-8-22(21)26(30)31/h5-8,10-16,27H,3-4,9,17H2,1-2H3,(H,30,31)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/a 126n/an/an/an/an/a



Punjabi University

Curated by ChEMBL


Assay Description
Antagonist activity at AT1 receptor in rat aortic rings


Bioorg Med Chem 16: 10210-5 (2008)

More data for this
Ligand-Target Pair
AGTR1


(RAT)
BDBM50412549
PNG
(CHEMBL465929)
Show SMILES CCCCNS(=O)(=O)c1ccc2n(Cc3ccc(cc3)-c3ccccc3C(O)=O)c(CCCC)nc2c1
Show InChI InChI=1S/C29H33N3O4S/c1-3-5-11-28-31-26-19-23(37(35,36)30-18-6-4-2)16-17-27(26)32(28)20-21-12-14-22(15-13-21)24-9-7-8-10-25(24)29(33)34/h7-10,12-17,19,30H,3-6,11,18,20H2,1-2H3,(H,33,34)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/a 100n/an/an/an/an/a



Punjabi University

Curated by ChEMBL


Assay Description
Antagonist activity at AT1 receptor in rat aortic rings


Bioorg Med Chem 16: 10210-5 (2008)

More data for this
Ligand-Target Pair
AGTR1


(RAT)
BDBM50412547
PNG
(CHEMBL517230)
Show SMILES CCCCc1nc2cc(ccc2n1Cc1ccc(cc1)-c1ccccc1C(O)=O)S(=O)(=O)NCC
Show InChI InChI=1S/C27H29N3O4S/c1-3-5-10-26-29-24-17-21(35(33,34)28-4-2)15-16-25(24)30(26)18-19-11-13-20(14-12-19)22-8-6-7-9-23(22)27(31)32/h6-9,11-17,28H,3-5,10,18H2,1-2H3,(H,31,32)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/a 79.4n/an/an/an/an/a



Punjabi University

Curated by ChEMBL


Assay Description
Antagonist activity at AT1 receptor in rat aortic rings


Bioorg Med Chem 16: 10210-5 (2008)

More data for this
Ligand-Target Pair