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Target
Acyl-protein thioesterase 1/2
Ligand
BDBM50547463
Substrate
n/a
Meas. Tech.
ChEMBL_2018313 (CHEMBL4671891)
IC50
460±n/a nM
Citation
 Vanhoutte, R; van de Plassche, MAT; Verhelst, SHL Rapid Solid-Phase Construction of Serine Hydrolase Probes Results in Selective Activity-Based Probes for Acyl Protein Thioesterases-1/2. J Med Chem 63:11845-11853 (2020) [PubMed]  Article 
Target
Name:
Acyl-protein thioesterase 1/2
Synonyms:
n/a
Type:
n/a
Mol. Mass.:
n/a
Description:
ASSAY_ID of ChEMBL is 2018313
Components:
This complex has 2 components.
Component 1
Name:
Acyl-protein thioesterase 1
Synonyms:
3.1.2.- | APT-1 | Acyl-protein thioesterase 1 | Apt1 | LPL-I | LYPA1_MOUSE | Lypla1 | LysoPLA I | Lysophospholipase 1 | Lysophospholipase I | Pla1a
Type:
PROTEIN
Mol. Mass.:
24687.95
Organism:
Mus musculus
Description:
ChEMBL_120125
Residue:
230
Sequence:
MCGNNMSAPMPAVVPAARKATAAVIFLHGLGDTGHGWAEAFAGIKSPHIKYICPHAPVMPVTLNMNMAMPSWFDIVGLSPDSQEDESGIKQAAETVKALIDQEVKNGIPSNRIILGGFSQGGALSLYTALTTQQKLAGVTALSCWLPLRASFSQGPINSANRDISVLQCHGDCDPLVPLMFGSLTVERLKALINPANVTFKIYEGMMHSSCQQEMMDVKHFIDKLLPPID
  
Component 2
Name:
Acyl-protein thioesterase 2
Synonyms:
3.1.2.- | APT-2 | Acyl-protein thioesterase 2 | LPL-II | LYPA2_MOUSE | Lypla2 | LysoPLA II | Lysophospholipase 2 | Lysophospholipase II | mLyso II
Type:
PROTEIN
Mol. Mass.:
24797.28
Organism:
Mus musculus
Description:
ChEMBL_120125
Residue:
231
Sequence:
MCGNTMSVPLLTDAATVSGAERETAAVIFLHGLGDTGHSWADALSTIRLPHVKYICPHAPRIPVTLNMKMVMPSWFDLMGLSPDAPEDEAGIKKAAENIKALIEHEMKNGIPANRIVLGGFSQGGALSLYTALTCPHPLAGIVALSCWLPLHRNFPQAANGSAKDLAILQCHGELDPMVPVRFGALTAEKLRTVVTPARVQFKTYPGVMHSSCPQEMAAVKEFLEKLLPPV
  
Inhibitor
Name:
BDBM50547463
Synonyms:
CHEMBL4778420
Type:
Small organic molecule
Emp. Form.:
C30H43N11O5
Mol. Mass.:
637.7331
SMILES:
NC(=O)[C@H](CCCCN=[N+]=[N-])NC(=O)CCCCCNC(=O)[C@H](Cc1ccccc1)NC(=O)C1CCN(CC1)C(=O)n1ccnn1 |r|
Structure:
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