Details of the Competitor

General Information of Competitor

Competitor ID
LDCM0595
Competitor Name
Fragment37
Synonyms
SCHEMBL18763046
Structure
3D MOL 2D MOL
Ro5 Violations (Lipinski): 0 Molecular Weight (mw) 274.29
Lipid-water partition coefficient (xlogp) 2.5
Rotatable Bond Count (rotbonds) 2
Hydrogen Bond Donor Count (hbonddonor) 0
Hydrogen Bond Acceptor Count (hbondacc) 4
Chemical Identifiers
Formula
C15H15FN2O2
IUPAC Name
1-[4-(5-fluoro-1,2-benzoxazol-3-yl)piperidin-1-yl]prop-2-en-1-one
Canonical SMILES
C=CC(=O)N1CCC(CC1)C2=NOC3=C2C=C(C=C3)F
InChI
InChI=1S/C15H15FN2O2/c1-2-14(19)18-7-5-10(6-8-18)15-12-9-11(16)3-4-13(12)20-17-15/h2-4,9-10H,1,5-8H2
InChIKey
YWOWINNNZMSMGC-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
IA-alkyne
 Probe Info  		100 uM Human burkitt lymphoma cell lysate (Ramos) [1]

Target(s) List of this Competitor

60 Enzyme Competed by This Competitor
Target Name Target ID Binding Ratio Interaction ID
26S proteasome regulatory subunit 10B (PSMC6) LDTP04987 0.76  LDD1432 
3-ketoacyl-CoA thiolase, mitochondrial (ACAA2) LDTP03998 1.16  LDD1432 
5'-nucleotidase domain-containing protein 1 (NT5DC1) LDTP17247 0.98  LDD1432 
6-phosphogluconolactonase (PGLS) LDTP14535 1.02  LDD1432 
60 kDa heat shock protein, mitochondrial (HSPD1) LDTP02522 0.92  LDD1432 
Acetyl-CoA acetyltransferase, mitochondrial (ACAT1) LDTP03291 0.78; 1.03; 0.86 ...  LDD1432 
Adenosine kinase (ADK) LDTP04689 1.12  LDD1432 
ADP-ribosylation factor-like protein 3 (ARL3) LDTP03806 0.82  LDD1432 
Arginine--tRNA ligase, cytoplasmic (RARS1) LDTP04601 1.04  LDD1432 
ATP-dependent 6-phosphofructokinase, platelet type (PFKP) LDTP05314 0.48; 0.60  LDD1432 
C-1-tetrahydrofolate synthase, cytoplasmic (MTHFD1) LDTP02580 0.86; 0.92  LDD1432 
Caspase-8 (CASP8) LDTP06211 1.02  LDD1432 
Cleavage and polyadenylation specificity factor subunit 3 (CPSF3) LDTP13449 0.92  LDD1432 
Cyclin-dependent kinase 19 (CDK19) LDTP11340 0.71  LDD1432 
Cyclin-dependent kinase 2 (CDK2) LDTP03299 0.90  LDD1432 
D-3-phosphoglycerate dehydrogenase (PHGDH) LDTP00701 1.02  LDD1432 
Deoxycytidine kinase (DCK) LDTP03400 0.91; 0.90  LDD1432 
Dynamin-2 (DNM2) LDTP04374 0.92  LDD1432 
Elongation factor 2 (EEF2) LDTP02672 0.91; 0.78  LDD1432 
Enoyl-CoA delta isomerase 2 (ECI2) LDTP01245 0.92  LDD1432 
ERO1-like protein alpha (ERO1A) LDTP10386 1.13; 1.25  LDD1432 
Eukaryotic translation initiation factor 3 subunit F (EIF3F) LDTP00246 0.84  LDD1432 
Glutaredoxin-related protein 5, mitochondrial (GLRX5) LDTP08181 0.85  LDD1432 
Glutathione S-transferase omega-1 (GSTO1) LDTP05128 1.27  LDD1432 
Glutathione S-transferase P (GSTP1) LDTP02333 1.19  LDD1432 
Glyceraldehyde-3-phosphate dehydrogenase (GAPDH) LDTP02038 0.78  LDD1432 
Glycerol-3-phosphate phosphatase (PGP) LDTP00089 0.97  LDD1432 
Inosine-5'-monophosphate dehydrogenase 2 (IMPDH2) LDTP02611 1.31  LDD1432 
Integrin-linked protein kinase (ILK) LDTP05859 1.01  LDD1432 
Isoamyl acetate-hydrolyzing esterase 1 homolog (IAH1) LDTP17082 0.97  LDD1432 
Ketosamine-3-kinase (FN3KRP) LDTP16025 1.02  LDD1432 
Lysine-specific demethylase 4B (KDM4B) LDTP01470 1.08  LDD1432 
Medium-chain acyl-CoA ligase ACSF2, mitochondrial (ACSF2) LDTP10177 0.86  LDD1432 
Monofunctional C1-tetrahydrofolate synthase, mitochondrial (MTHFD1L) LDTP07651 0.95  LDD1432 
N-alpha-acetyltransferase 15, NatA auxiliary subunit (NAA15) LDTP11388 0.79  LDD1432 
Omega-amidase NIT2 (NIT2) LDTP12428 0.95  LDD1432 
Peptidyl-prolyl cis-trans isomerase NIMA-interacting 1 (PIN1) LDTP05912 0.91  LDD1432 
Peroxiredoxin-4 (PRDX4) LDTP05773 1.24  LDD1432 
Peroxiredoxin-5, mitochondrial (PRDX5) LDTP03512 0.91  LDD1432 
Persulfide dioxygenase ETHE1, mitochondrial (ETHE1) LDTP01633 0.87  LDD1432 
Probable ATP-dependent RNA helicase DDX59 (DDX59) LDTP07098 1.04  LDD1432 
Prostaglandin E synthase 3 (PTGES3) LDTP06338 0.84  LDD1432 
Protein arginine N-methyltransferase 1 (PRMT1) LDTP10997 0.99  LDD1432 
Protein disulfide-isomerase A3 (PDIA3) LDTP03521 0.92  LDD1432 
Protein disulfide-isomerase A4 (PDIA4) LDTP02677 1.10; 0.92  LDD1432 
Protein disulfide-isomerase A6 (PDIA6) LDTP06314 0.95  LDD1432 
Protein-L-isoaspartate(D-aspartate) O-methyltransferase (PCMT1) LDTP03152 0.84  LDD1432 
Pyrroline-5-carboxylate reductase 1, mitochondrial (PYCR1) LDTP03644 0.97  LDD1432 
Pyruvate kinase PKM (PKM) LDTP02733 0.90  LDD1432 
Serine--tRNA ligase, cytoplasmic (SARS1) LDTP04265 0.73  LDD1432 
Serine/threonine-protein kinase Nek9 (NEK9) LDTP09412 1.40  LDD1432 
Serine/threonine-protein phosphatase CPPED1 (CPPED1) LDTP11107 1.00  LDD1432 
Small ribosomal subunit protein uS3 (RPS3) LDTP03223 1.22  LDD1432 
SWI/SNF-related matrix-associated actin-dependent regulator of chromatin subfamily A containing DEAD/H box 1 (SMARCAD1) LDTP11931 0.77  LDD1432 
Thioredoxin (TXN) LDTP02502 1.15  LDD1432 
Thymidine kinase, cytosolic (TK1) LDTP02022 0.90  LDD1432 
Transmembrane protease serine 12 (TMPRSS12) LDTP15306 0.77  LDD1432 
Tubulin alpha-1A chain (TUBA1A) LDTP07907 0.91; 0.95  LDD1432 
Tubulin alpha-4A chain (TUBA4A) LDTP05075 0.87; 0.90; 0.89  LDD1432 
UDP-N-acetylglucosamine--peptide N-acetylglucosaminyltransferase 110 kDa subunit (OGT) LDTP00601 0.83  LDD1432 
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⏷ Show the Full List of 60 Enzyme
13 Transporter and channel Competed by This Competitor
Target Name Target ID Binding Ratio Interaction ID
Apoptotic chromatin condensation inducer in the nucleus (ACIN1) LDTP13490 0.87  LDD1432 
ATP synthase subunit alpha, mitochondrial (ATP5F1A) LDTP03327 1.01  LDD1432 
Chloride intracellular channel protein 1 (CLIC1) LDTP00244 1.00  LDD1432 
Chloride intracellular channel protein 4 (CLIC4) LDTP14222 0.97  LDD1432 
Exportin-1 (XPO1) LDTP00501 0.85; 0.88  LDD1432 
Exportin-2 (CSE1L) LDTP04662 1.00  LDD1432 
Gasdermin-D (GSDMD) LDTP04801 1.15  LDD1432 
Nuclear pore complex protein Nup93 (NUP93) LDTP08769 1.20  LDD1432 
Protein SEC13 homolog (SEC13) LDTP04707 0.88  LDD1432 
Signal recognition particle 9 kDa protein (SRP9) LDTP04259 0.82  LDD1432 
Small ribosomal subunit protein RACK1 (RACK1) LDTP05057 0.86  LDD1432 
Sorting nexin-6 (SNX6) LDTP13661 0.95  LDD1432 
Thioredoxin domain-containing protein 17 (TXNDC17) LDTP11103 1.22  LDD1432 
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⏷ Show the Full List of 13 Transporter and channel
4 Transcription factor Competed by This Competitor
Target Name Target ID Binding Ratio Interaction ID
CDKN2A-interacting protein (CDKN2AIP) LDTP12792 0.75  LDD1432 
eIF5-mimic protein 2 (BZW1) LDTP07940 0.85  LDD1432 
Glucocorticoid receptor (NR3C1) LDTP02016 0.87  LDD1432 
Zinc finger protein 217 (ZNF217) LDTP01191 0.90  LDD1432 
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59 Other Competed by This Competitor
Target Name Target ID Binding Ratio Interaction ID
Actin-related protein 2/3 complex subunit 3 (ARPC3) LDTP00552 1.04  LDD1432 
Actin-related protein 3 (ACTR3) LDTP04902 1.03  LDD1432 
Aminoacyl tRNA synthase complex-interacting multifunctional protein 2 (AIMP2) LDTP05770 0.87  LDD1432 
Ataxin-7-like protein 3B (ATXN7L3B) LDTP15730 0.82  LDD1432 
Calponin-2 (CNN2) LDTP10864 0.84; 0.81  LDD1432 
cAMP-dependent protein kinase type I-alpha regulatory subunit (PRKAR1A) LDTP02511 1.09  LDD1432 
Cleavage stimulation factor subunit 2 (CSTF2) LDTP03665 0.87  LDD1432 
Condensin complex subunit 1 (NCAPD2) LDTP06281 0.95  LDD1432 
Conserved oligomeric Golgi complex subunit 1 (COG1) LDTP09549 0.91  LDD1432 
Coronin-1C (CORO1C) LDTP13580 0.91  LDD1432 
Crk-like protein (CRKL) LDTP04092 1.02  LDD1432 
Cytoplasmic dynein 1 heavy chain 1 (DYNC1H1) LDTP06083 0.78  LDD1432 
DNA mismatch repair protein Msh2 (MSH2) LDTP04028 0.87  LDD1432 
Dynactin subunit 1 (DCTN1) LDTP06082 1.28  LDD1432 
Dynamin-binding protein (DNMBP) LDTP07755 0.98  LDD1432 
Enhancer of mRNA-decapping protein 3 (EDC3) LDTP10299 0.84  LDD1432 
Eukaryotic translation initiation factor 3 subunit M (EIF3M) LDTP07947 0.73  LDD1432 
GrpE protein homolog 1, mitochondrial (GRPEL1) LDTP12144 0.83  LDD1432 
H/ACA ribonucleoprotein complex subunit 2 (NHP2) LDTP12754 0.93  LDD1432 
Heterogeneous nuclear ribonucleoprotein F (HNRNPF) LDTP04514 0.95  LDD1432 
Heterogeneous nuclear ribonucleoprotein R (HNRNPR) LDTP00756 0.81  LDD1432 
Heterogeneous nuclear ribonucleoprotein U (HNRNPU) LDTP05259 1.34  LDD1432 
Hsp70-binding protein 1 (HSPBP1) LDTP12914 0.94  LDD1432 
Kinetochore protein NDC80 homolog (NDC80) LDTP00431 0.97  LDD1432 
Lamina-associated polypeptide 2, isoform alpha (TMPO) LDTP03967 1.01; 0.95; 0.90 ...  LDD1432 
Large ribosomal subunit protein eL24 (RPL24) LDTP05186 0.90; 1.01  LDD1432 
Large ribosomal subunit protein eL30 (RPL30) LDTP05021 0.94  LDD1432 
Large ribosomal subunit protein uL14 (RPL23) LDTP05008 1.03  LDD1432 
Large ribosomal subunit protein uL16 (RPL10) LDTP03395 0.86  LDD1432 
Large ribosomal subunit protein uL4 (RPL4) LDTP03815 0.88  LDD1432 
Mediator of RNA polymerase II transcription subunit 15 (MED15) LDTP10771 0.77  LDD1432 
MMS19 nucleotide excision repair protein homolog (MMS19) LDTP10843 1.03  LDD1432 
Nuclear migration protein nudC (NUDC) LDTP13817 1.10  LDD1432 
Nuclear mitotic apparatus protein 1 (NUMA1) LDTP06244 1.15  LDD1432 
NudC domain-containing protein 1 (NUDCD1) LDTP10781 0.89  LDD1432 
Poly(rC)-binding protein 1 (PCBP1) LDTP06366 0.73; 1.03  LDD1432 
Proteasome activator complex subunit 1 (PSME1) LDTP05484 1.04  LDD1432 
Proteasome activator complex subunit 4 (PSME4) LDTP06250 1.04  LDD1432 
Protein diaphanous homolog 1 (DIAPH1) LDTP01011 0.75  LDD1432 
Protein PAXX (PAXX) LDTP11235 0.94  LDD1432 
Protein unc-45 homolog A (UNC45A) LDTP11890 0.86  LDD1432 
RAB7A-interacting MON1-CCZ1 complex subunit 1 (RIMOC1) LDTP14351 1.13  LDD1432 
Small ribosomal subunit protein eS27 (RPS27) LDTP03987 0.85  LDD1432 
Small ribosomal subunit protein eS4, X isoform (RPS4X) LDTP04997 0.86  LDD1432 
Small ribosomal subunit protein uS12 (RPS23) LDTP04971 0.96  LDD1432 
Small ribosomal subunit protein uS17 (RPS11) LDTP04975 1.44  LDD1432 
Small ribosomal subunit protein uS7 (RPS5) LDTP04110 1.77  LDD1432 
Stalled ribosome sensor GCN1 (GCN1) LDTP09821 0.91  LDD1432 
Stress-70 protein, mitochondrial (HSPA9) LDTP03860 0.75  LDD1432 
T-complex protein 1 subunit eta (CCT7) LDTP10990 0.98  LDD1432 
T-complex protein 1 subunit theta (CCT8) LDTP04390 0.80  LDD1432 
TBC1 domain family member 23 (TBC1D23) LDTP12651 0.78  LDD1432 
THUMP domain-containing protein 1 (THUMPD1) LDTP12780 0.90  LDD1432 
Trafficking protein particle complex subunit 4 (TRAPPC4) LDTP13837 0.86  LDD1432 
Transcription elongation regulator 1 (TCERG1) LDTP00430 0.82  LDD1432 
Transcription initiation factor IIA subunit 2 (GTF2A2) LDTP04517 1.14  LDD1432 
Tubulin beta chain (TUBB) LDTP02205 0.94; 0.90  LDD1432 
Tubulin-specific chaperone D (TBCD) LDTP11212 0.94  LDD1432 
ZW10 interactor (ZWINT) LDTP01532 1.05  LDD1432 
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⏷ Show the Full List of 59 Other

Full Information of The Labelling Profiles of This Competitor

IA-alkyne
 Probe Info 
Quantification: Probe vs (Probe+Competitor)
  
Experiment 1 Reporting the Labelling Profiles of This Probe
REF [1]
Probe concentration 100 uM
Quantitative Method Isotope tag
Competitor Name Fragment37
Competitor Concentration 500 uM
In Vitro Experiment Model Model Type
Cell lysate
Derived Tissue
Lymph node
Disease Model Burkitt lymphoma [ICD-11:2A85]
Model Name Human burkitt lymphoma cell lysate (Ramos)
Interaction Atlas ID  LDD1432  Download The Altas

References

1 Proteome-wide covalent ligand discovery in native biological systems. Nature. 2016 Jun 23;534(7608):570-4. doi: 10.1038/nature18002. Epub 2016 Jun 15.