Details of the Competitor

General Information of Competitor

Competitor ID
LDCM0096
Competitor Name
SAHA
Synonyms
CHEMBL4061138
Structure
3D MOL 2D MOL
Ro5 Violations (Lipinski): 0 Molecular Weight (mw) 208.21
Lipid-water partition coefficient (xlogp) -0.2
Rotatable Bond Count (rotbonds) 4
Hydrogen Bond Donor Count (hbonddonor) 3
Hydrogen Bond Acceptor Count (hbondacc) 3
Chemical Identifiers
Formula
C10H12N2O3
IUPAC Name
N'-hydroxy-N-phenylbutanediamide
Canonical SMILES
C1=CC=C(C=C1)NC(=O)CCC(=O)NO
InChI
InChI=1S/C10H12N2O3/c13-9(6-7-10(14)12-15)11-8-4-2-1-3-5-8/h1-5,15H,6-7H2,(H,11,13)(H,12,14)
InChIKey
ZOZAGABBONSMOY-UHFFFAOYSA-N

The Competitor Interaction Atlas

Probe(s) Related This Competitor

ABPP Probe
Click To Hide/Show 1 Probe Related to This Competitor
Probe Name Structure Concentration Cell-system Ref
SAHA-CA-4PAP
 Probe Info  		3 uM Human chronic myeloid leukemia cell lysate (K562) [1]
PAL-AfBPP Probe
Click To Hide/Show 2 Probe Related to This Competitor
Probe Name Structure Concentration Cell-system Ref
SAHA-CA-8PAP
 Probe Info  		1 uM Human chronic myeloid leukemia cell lysate (K562) [1]
SAHA-CA-3PAP
 Probe Info  		1 uM Human chronic myeloid leukemia cell lysate (K562) [1]

Target(s) List of this Competitor

34 Enzyme Competed by This Competitor
Target Name Target ID Binding Ratio Interaction ID
2-aminoethanethiol dioxygenase (ADO) LDTP10828 11.50  LDD0269 
Beta-glucuronidase (GUSB) LDTP02260 5.50  LDD0269 
Bifunctional methylenetetrahydrofolate dehydrogenase/cyclohydrolase, mitochondrial (MTHFD2) LDTP02706 4.00  LDD0360 
CDGSH iron-sulfur domain-containing protein 1 (CISD1) LDTP12873 6.00  LDD0360 
Cytochrome b-c1 complex subunit 8 (UQCRQ) LDTP00486 5.00  LDD0269 
Cytochrome c oxidase assembly factor 7 (COA7) LDTP10137 4.00  LDD0360 
Dihydrolipoyllysine-residue acetyltransferase component of pyruvate dehydrogenase complex, mitochondrial (DLAT) LDTP02497 4.00  LDD0363 
Dynamin-2 (DNM2) LDTP04374 6.50  LDD0362 
E3 ubiquitin-protein ligase MARCHF5 (MARCHF5) LDTP12757 5.70  LDD0269 
Eukaryotic initiation factor 4A-II (EIF4A2) LDTP06089 15.30  LDD0269 
Fatty acid CoA ligase Acsl3 (ACSL3) LDTP01634 4.33  LDD0269 
Histone acetyltransferase type B catalytic subunit (HAT1) LDTP00479 4.00  LDD0361 
Histone deacetylase 1 (HDAC1) LDTP05918 20.00  LDD0269 
Histone deacetylase 2 (HDAC2) LDTP09865 20.00  LDD0269 
Histone deacetylase 3 (HDAC3) LDTP00622 20.00  LDD0269 
Histone deacetylase 6 (HDAC6) LDTP13136 20.00  LDD0269 
Histone deacetylase 8 (HDAC8) LDTP11433 7.00  LDD0269 
Isochorismatase domain-containing protein 2 (ISOC2) LDTP18123 4.76  LDD0269 
Kinesin-like protein KIF2C (KIF2C) LDTP10935 5.30  LDD0269 
Lysine-specific histone demethylase 1A (KDM1A) LDTP00957 10.70  LDD0269 
Methionine synthase (MTR) LDTP10951 4.33  LDD0362 
Methionine--tRNA ligase, cytoplasmic (MARS1) LDTP04730 4.25  LDD0269 
Minor histocompatibility antigen H13 (HM13) LDTP09396 4.00  LDD0269 
NADPH--cytochrome P450 reductase (POR) LDTP02848 4.50  LDD0269 
Peptidyl-prolyl cis-trans isomerase FKBP8 (FKBP8) LDTP06104 4.14  LDD0362 
Phenylalanine--tRNA ligase beta subunit (FARSB) LDTP12586 4.00  LDD0269 
Probable hydrolase PNKD (PNKD) LDTP08858 13.00  LDD0269 
Ras-related protein Rab-14 (RAB14) LDTP04901 .  LDD0362 
Ras-related protein Rab-8A (RAB8A) LDTP04888 .  LDD0362 
Sarcoplasmic/endoplasmic reticulum calcium ATPase 3 (ATP2A3) LDTP09976 4.20  LDD0269 
Serine/threonine-protein phosphatase PP1-alpha catalytic subunit (PPP1CA) LDTP04959 4.00  LDD0360 
Thioredoxin domain-containing protein 12 (TXNDC12) LDTP01707 5.50  LDD0362 
Transaldolase (TALDO1) LDTP03847 5.00  LDD0360 
X-ray repair cross-complementing protein 6 (XRCC6) LDTP02640 4.50  LDD0360 
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⏷ Show the Full List of 34 Enzyme
9 Transporter and channel Competed by This Competitor
Target Name Target ID Binding Ratio Interaction ID
Fatty acid-binding protein 5 (FABP5) LDTP05292 .  LDD0362 
Importin subunit alpha-3 (KPNA4) LDTP00328 4.50  LDD0362 
Importin-9 (IPO9) LDTP10663 5.50  LDD0362 
Large neutral amino acids transporter small subunit 1 (SLC7A5) LDTP05305 5.50  LDD0362 
Nuclear pore complex protein Nup160 (NUP160) LDTP05642 4.00  LDD0362 
Protein transport protein Sec31A (SEC31A) LDTP01478 4.67  LDD0362 
Stomatin-like protein 2, mitochondrial (STOML2) LDTP13416 .  LDD0361 
Tricarboxylate transport protein, mitochondrial (SLC25A1) LDTP04553 5.50  LDD0269 
V-type proton ATPase subunit B, brain isoform (ATP6V1B2) LDTP03104 4.33  LDD0361 
------------------------------------------------------------------------------------
⏷ Show the Full List of 9 Transporter and channel
4 Transcription factor Competed by This Competitor
Target Name Target ID Binding Ratio Interaction ID
Mesoderm induction early response protein 1 (MIER1) LDTP08741 11.30  LDD0269 
Metastasis-associated protein MTA1 (MTA1) LDTP05830 .  LDD0360 
Metastasis-associated protein MTA2 (MTA2) LDTP01414 14.00  LDD0269 
Signal transducer and activator of transcription 3 (STAT3) LDTP03903 4.50  LDD0269 
------------------------------------------------------------------------------------
36 Other Competed by This Competitor
Target Name Target ID Binding Ratio Interaction ID
14-3-3 protein beta/alpha (YWHAB) LDTP03617 5.30  LDD0269 
Actin-related protein 2/3 complex subunit 3 (ARPC3) LDTP00552 5.00  LDD0362 
Cleavage and polyadenylation specificity factor subunit 6 (CPSF6) LDTP06584 5.50  LDD0269 
Desmocollin-1 (DSC1) LDTP05567 7.00  LDD0362 
Desmoglein-1 (DSG1) LDTP05353 4.13  LDD0362 
DNA mismatch repair protein Msh6 (MSH6) LDTP04518 4.33  LDD0362 
Eukaryotic translation initiation factor 3 subunit E (EIF3E) LDTP04853 4.00  LDD0361 
F-box-like/WD repeat-containing protein TBL1XR1 (TBL1XR1) LDTP11544 13.70  LDD0269 
Fanconi anemia group I protein (FANCI) LDTP12680 4.20  LDD0362 
Filaggrin-2 (FLG2) LDTP06958 5.00  LDD0362 
Four and a half LIM domains protein 3 (FHL3) LDTP05962 4.50  LDD0269 
Golgi phosphoprotein 3 (GOLPH3) LDTP11911 4.50  LDD0360 
Hsp70-binding protein 1 (HSPBP1) LDTP12914 4.00  LDD0360 
Involucrin (IVL) LDTP02207 .  LDD0362 
Junction plakoglobin (JUP) LDTP02756 5.71  LDD0362 
Keratin, type I cuticular Ha1 (KRT31) LDTP06357 .  LDD0361 
Keratin, type I cuticular Ha4 (KRT34) LDTP01375 .  LDD0361 
Keratin, type I cuticular Ha6 (KRT36) LDTP01376 .  LDD0361 
Keratin, type II cuticular Hb2 (KRT82) LDTP12579 .  LDD0361 
Keratin, type II cuticular Hb4 (KRT84) LDTP12578 .  LDD0361 
Keratin, type II cuticular Hb5 (KRT85) LDTP05119 .  LDD0361 
Keratin, type II cuticular Hb6 (KRT86) LDTP00868 .  LDD0361 
Large ribosomal subunit protein eL36 (RPL36) LDTP14012 4.00  LDD0269 
Nuclear speckle splicing regulatory protein 1 (NSRP1) LDTP11709 5.50  LDD0362 
Paired amphipathic helix protein Sin3a (SIN3A) LDTP10823 17.00  LDD0269 
Paired amphipathic helix protein Sin3b (SIN3B) LDTP01156 12.30  LDD0269 
Plakophilin-1 (PKP1) LDTP05990 4.00  LDD0361 
Protein S100-A9 (S100A9) LDTP02152 .  LDD0362 
Protein unc-45 homolog A (UNC45A) LDTP11890 4.50  LDD0362 
Putative heat shock protein HSP 90-beta 4 (HSP90AB4P) LDTP17159 7.30  LDD0269 
Reticulon-3 (RTN3) LDTP01522 9.30  LDD0269 
Serpin B3 (SERPINB3) LDTP03493 .  LDD0362 
Splicing factor 1 (SF1) LDTP06429 6.00  LDD0363 
Tetratricopeptide repeat protein 38 (TTC38) LDTP19372 20.00  LDD0269 
Tubulin beta-2A chain (TUBB2A) LDTP05998 .  LDD0362 
Tubulin beta-6 chain (TUBB6) LDTP11233 .  LDD0360 
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⏷ Show the Full List of 36 Other

Full Information of The Labelling Profiles of This Competitor

SAHA-CA-4PAP
 Probe Info 
Quantification: Probe vs (Probe+Competitor)
  
Experiment 1 Reporting the Labelling Profiles of This Probe
REF [1]
Probe concentration 1 uM
Quantitative Method LFQ
Competitor Name SAHA
Competitor Concentration 20 uM
In Vitro Experiment Model Model Type
Cell lysate
Derived Tissue
Peripheral blood
Disease Model Chronic myeloid leukemia [ICD-11:2A20]
Model Name Human chronic myeloid leukemia cell lysate (K562)
Interaction Atlas ID  LDD0269  Download The Altas
  
Experiment 2 Reporting the Labelling Profiles of This Probe
REF [1]
Probe concentration 3 uM
Quantitative Method LFQ
Competitor Name SAHA
Competitor Concentration 20 uM
In Vitro Experiment Model Model Type
Cell lysate
Derived Tissue
Peripheral blood
Disease Model Chronic myeloid leukemia [ICD-11:2A20]
Model Name Human chronic myeloid leukemia cell lysate (K562)
Interaction Atlas ID  LDD0360  Download The Altas
  
Experiment 3 Reporting the Labelling Profiles of This Probe
REF [1]
Probe concentration 0.3 uM
Quantitative Method LFQ
Competitor Name SAHA
Competitor Concentration 20 uM
In Vitro Experiment Model Model Type
Cell lysate
Derived Tissue
Peripheral blood
Disease Model Chronic myeloid leukemia [ICD-11:2A20]
Model Name Human chronic myeloid leukemia cell lysate (K562)
Interaction Atlas ID  LDD0361  Download The Altas

SAHA-CA-3PAP
 Probe Info 
Quantification: Probe vs (Probe+Competitor)
  
Experiment 1 Reporting the Labelling Profiles of This Probe
REF [1]
Probe concentration 1 uM
Quantitative Method LFQ
Competitor Name SAHA
Competitor Concentration 20 uM
In Vitro Experiment Model Model Type
Cell lysate
Derived Tissue
Peripheral blood
Disease Model Chronic myeloid leukemia [ICD-11:2A20]
Model Name Human chronic myeloid leukemia cell lysate (K562)
Interaction Atlas ID  LDD0363  Download The Altas

SAHA-CA-8PAP
 Probe Info 
Quantification: Probe vs (Probe+Competitor)
  
Experiment 1 Reporting the Labelling Profiles of This Probe
REF [1]
Probe concentration 1 uM
Quantitative Method LFQ
Competitor Name SAHA
Competitor Concentration 20 uM
In Vitro Experiment Model Model Type
Cell lysate
Derived Tissue
Peripheral blood
Disease Model Chronic myeloid leukemia [ICD-11:2A20]
Model Name Human chronic myeloid leukemia cell lysate (K562)
Interaction Atlas ID  LDD0362  Download The Altas

References

1 Streamlined Target Deconvolution Approach Utilizing a Single Photoreactive Chloroalkane Capture Tag. ACS Chem Biol. 2021 Feb 19;16(2):404-413. doi: 10.1021/acschembio.0c00987. Epub 2021 Feb 5.