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Target
Acrosin
Ligand
BDBM50018976
Substrate
n/a
Meas. Tech.
ChEMBL_1365286 (CHEMBL3292380)
IC50
7800±n/a nM
Citation
 Zhao, J; Tian, W; Qi, J; Lv, D; Liu, Y; Jiang, Y; Dong, G; Chen, Q; Zhou, Y; Zhu, J; Wang, H; Sheng, C; Lv, J Design and synthesis of phenylisoxazole derivatives as novel human acrosin inhibitors. Bioorg Med Chem Lett 24:2802-6 (2014) [PubMed]  Article 
Target
Name:
Acrosin
Synonyms:
ACR | ACRO_HUMAN | ACRS
Type:
PROTEIN
Mol. Mass.:
45865.48
Organism:
Homo sapiens (Human)
Description:
ChEMBL_1365286
Residue:
421
Sequence:
MVEMLPTAILLVLAVSVVAKDNATCDGPCGLRFRQNPQGGVRIVGGKAAQHGAWPWMVSLQIFTYNSHRYHTCGGSLLNSRWVLTAAHCFVGKNNVHDWRLVFGAKEITYGNNKPVKAPLQERYVEKIIIHEKYNSATEGNDIALVEITPPISCGRFIGPGCLPHFKAGLPRGSQSCWVAGWGYIEEKAPRPSSILMEARVDLIDLDLCNSTQWYNGRVQPTNVCAGYPVGKIDTCQGDSGGPLMCKDSKESAYVVVGITSWGVGCARAKRPGIYTATWPYLNWIASKIGSNALRMIQSATPPPPTTRPPPIRPPFSHPISAHLPWYFQPPPRPLPPRPPAAQPRPPPSPPPPPPPPASPLPPPPPPPPPTPSSTTKLPQGLSFAKRLQQLIEVLKGKTYSDGKNHYDMETTELPELTSTS
  
Inhibitor
Name:
BDBM50018976
Synonyms:
CHEMBL3287448
Type:
Small organic molecule
Emp. Form.:
C21H24ClN5O2
Mol. Mass.:
413.901
SMILES:
Cl.CC(C)(C)c1ccc(NC(=O)c2cc(on2)-c2ccc(NC(N)=N)cc2)cc1
Structure:
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