Target
Tumor necrosis factor receptor superfamily member 1A
Ligand
BDBM50123305
Substrate
n/a
Meas. Tech.
ChEBML_212214
IC50
1000±n/a nM
Citation
 Voss, MECarter, PHTebben, AJScherle, PABrown, GDThompson, LAXu, MLo, YCYang, GLiu, RQStrzemienski, PEverlof, JGTrzaskos, JMDecicco, CP Both 5-arylidene-2-thioxodihydropyrimidine-4,6(1H,5H)-diones and 3-thioxo-2,3-dihydro-1H-imidazo[1,5-a]indol-1-ones are light-dependent tumor necrosis factor-alpha antagonists. Bioorg Med Chem Lett 13:533-8 (2003) [PubMed]  Article 
Target
Name:
Tumor necrosis factor receptor superfamily member 1A
Synonyms:
CD_antigen=CD120a | TBPI | TNF-R1 | TNF-RI | TNFAR | TNFR-I | TNFR1 | TNFRSF1A | TNR1A_HUMAN | Tumor necrosis factor receptor R1 | Tumor necrosis factor receptor superfamily member 1A | Tumor necrosis factor receptor superfamily member 1A, membrane form | Tumor necrosis factor-binding protein 1 | p55 | p60
Type:
PROTEIN
Mol. Mass.:
50495.39
Organism:
Homo sapiens (Human)
Description:
ChEMBL_1509419
Residue:
455
Sequence:
MGLSTVPDLLLPLVLLELLVGIYPSGVIGLVPHLGDREKRDSVCPQGKYIHPQNNSICCTKCHKGTYLYNDCPGPGQDTDCRECESGSFTASENHLRHCLSCSKCRKEMGQVEISSCTVDRDTVCGCRKNQYRHYWSENLFQCFNCSLCLNGTVHLSCQEKQNTVCTCHAGFFLRENECVSCSNCKKSLECTKLCLPQIENVKGTEDSGTTVLLPLVIFFGLCLLSLLFIGLMYRYQRWKSKLYSIVCGKSTPEKEGELEGTTTKPLAPNPSFSPTPGFTPTLGFSPVPSSTFTSSSTYTPGDCPNFAAPRREVAPPYQGADPILATALASDPIPNPLQKWEDSAHKPQSLDTDDPATLYAVVENVPPLRWKEFVRRLGLSDHEIDRLELQNGRCLREAQYSMLATWRRRTPRREATLELLGRVLRDMDLLGCLEDIEEALCGPAALPPAPSLLR
  
Inhibitor
Name:
BDBM50123305
Synonyms:
1,3-Diethyl-5-(1H-indol-3-ylmethylene)-2-thioxo-dihydro-pyrimidine-4,6-dione | CHEMBL345500
Type:
Small organic molecule
Emp. Form.:
C17H17N3O2S
Mol. Mass.:
327.401
SMILES:
CCN1C(=S)N(CC)C(=O)C(=Cc2c[nH]c3ccccc23)C1=O |(13.38,3.48,;12.98,1.98,;14.08,.88,;13.75,-.63,;12.28,-1.1,;14.89,-1.67,;14.48,-3.16,;15.56,-4.26,;16.37,-1.2,;17.51,-2.23,;16.68,.3,;18.15,.79,;19.3,-.26,;19.13,-1.78,;20.54,-2.42,;21.57,-1.27,;23.11,-1.27,;23.88,.06,;23.11,1.39,;21.57,1.39,;20.81,.07,;15.55,1.35,;15.88,2.85,)|
Structure:
Search PDB for entries with ligand similarity: