Details of the Competitor

General Information of Competitor

Competitor ID
LDCM0605
Competitor Name
Fragment47
Synonyms
SCHEMBL18285190
Structure
3D MOL 2D MOL
Ro5 Violations (Lipinski): 0 Molecular Weight (mw) 252.11
Lipid-water partition coefficient (xlogp) 2.6
Rotatable Bond Count (rotbonds) 1
Hydrogen Bond Donor Count (hbonddonor) 0
Hydrogen Bond Acceptor Count (hbondacc) 1
Chemical Identifiers
Formula
C11H10BrNO
IUPAC Name
1-(5-bromo-2,3-dihydroindol-1-yl)prop-2-en-1-one
Canonical SMILES
C=CC(=O)N1CCC2=C1C=CC(=C2)Br
InChI
InChI=1S/C11H10BrNO/c1-2-11(14)13-6-5-8-7-9(12)3-4-10(8)13/h2-4,7H,1,5-6H2
InChIKey
GFSRKGXIDBTJBQ-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 breast adenocarcinoma cell lysate (MDA-MB-231) [1]

Target(s) List of this Competitor

86 Enzyme Competed by This Competitor
Target Name Target ID Binding Ratio Interaction ID
26S proteasome regulatory subunit 10B (PSMC6) LDTP04987 0.66  LDD1446 
26S proteasome regulatory subunit 6B (PSMC4) LDTP04061 0.66  LDD1446 
3-hydroxyacyl-CoA dehydrogenase type-2 (HSD17B10) LDTP10954 1.41  LDD1446 
3-ketoacyl-CoA thiolase, peroxisomal (ACAA1) LDTP02329 1.15  LDD1446 
5'-nucleotidase domain-containing protein 1 (NT5DC1) LDTP17247 1.09  LDD1446 
6-phosphogluconolactonase (PGLS) LDTP14535 1.22  LDD1446 
60 kDa heat shock protein, mitochondrial (HSPD1) LDTP02522 1.29  LDD1446 
Acetyl-CoA acetyltransferase, mitochondrial (ACAT1) LDTP03291 1.02; 1.06; 0.87 ...  LDD1446 
Adenosine 5'-monophosphoramidase HINT1 (HINT1) LDTP04306 0.87  LDD1446 
Adenosine kinase (ADK) LDTP04689 1.39  LDD1446 
Aldo-keto reductase family 1 member B1 (AKR1B1) LDTP02765 1.10  LDD1446 
ATP-dependent 6-phosphofructokinase, platelet type (PFKP) LDTP05314 0.83  LDD1446 
ATPase WRNIP1 (WRNIP1) LDTP10801 1.32  LDD1446 
Bifunctional phosphoribosylaminoimidazole carboxylase/phosphoribosylaminoimidazole succinocarboxamide synthetase (PAICS) LDTP03159 1.10  LDD1446 
C-1-tetrahydrofolate synthase, cytoplasmic (MTHFD1) LDTP02580 1.24  LDD1446 
Calpain-2 catalytic subunit (CAPN2) LDTP02911 0.94  LDD1446 
Cathepsin B (CTSB) LDTP02223 1.24; 1.75  LDD1446 
Cathepsin D (CTSD) LDTP02198 1.92  LDD1446 
Cathepsin Z (CTSZ) LDTP13147 0.94  LDD1446 
Cell cycle checkpoint control protein RAD9A (RAD9A) LDTP10929 1.39  LDD1446 
Cytidine deaminase (CDA) LDTP03642 1.97  LDD1446 
Deaminated glutathione amidase (NIT1) LDTP15311 0.64  LDD1446 
Deoxycytidine kinase (DCK) LDTP03400 1.74  LDD1446 
DNA repair protein RAD50 (RAD50) LDTP09912 1.18  LDD1446 
Double-stranded RNA-specific adenosine deaminase (ADAR) LDTP04690 1.20  LDD1446 
Dual specificity mitogen-activated protein kinase kinase 3 (MAP2K3) LDTP04103 1.16  LDD1446 
Dual specificity mitogen-activated protein kinase kinase 4 (MAP2K4) LDTP04077 1.11  LDD1446 
Dual specificity protein phosphatase 12 (DUSP12) LDTP13663 0.88  LDD1446 
Dynamin-1-like protein (DNM1L) LDTP00273 3.28  LDD1446 
Dynamin-2 (DNM2) LDTP04374 1.36  LDD1446 
Elongation factor 2 (EEF2) LDTP02672 1.24  LDD1446 
Elongation factor Tu, mitochondrial (TUFM) LDTP04251 1.57  LDD1446 
Enoyl-CoA delta isomerase 2 (ECI2) LDTP01245 1.34  LDD1446 
ERO1-like protein alpha (ERO1A) LDTP10386 1.05; 1.48  LDD1446 
Eukaryotic translation initiation factor 3 subunit F (EIF3F) LDTP00246 1.19  LDD1446 
Glutaredoxin-1 (GLRX) LDTP03786 0.83  LDD1446 
Glutaredoxin-related protein 5, mitochondrial (GLRX5) LDTP08181 0.98  LDD1446 
Glutathione S-transferase omega-1 (GSTO1) LDTP05128 1.15  LDD1446 
Glutathione S-transferase P (GSTP1) LDTP02333 2.51  LDD1446 
Glyceraldehyde-3-phosphate dehydrogenase (GAPDH) LDTP02038 0.95  LDD1446 
Glycerol-3-phosphate phosphatase (PGP) LDTP00089 1.06  LDD1446 
Inosine-5'-monophosphate dehydrogenase 2 (IMPDH2) LDTP02611 1.23; 1.35  LDD1446 
Isocitrate dehydrogenase [NADP] cytoplasmic (IDH1) LDTP01333 0.91  LDD1446 
Isocitrate dehydrogenase [NADP], mitochondrial (IDH2) LDTP04211 1.24  LDD1446 
Ketosamine-3-kinase (FN3KRP) LDTP16025 1.30  LDD1446 
Medium-chain acyl-CoA ligase ACSF2, mitochondrial (ACSF2) LDTP10177 1.08  LDD1446 
Mitogen-activated protein kinase 9 (MAPK9) LDTP04076 0.90  LDD1446 
Monofunctional C1-tetrahydrofolate synthase, mitochondrial (MTHFD1L) LDTP07651 1.41  LDD1446 
Multifunctional procollagen lysine hydroxylase and glycosyltransferase LH3 (PLOD3) LDTP01005 1.15  LDD1446 
N-alpha-acetyltransferase 15, NatA auxiliary subunit (NAA15) LDTP11388 1.13  LDD1446 
NEDD8-activating enzyme E1 catalytic subunit (UBA3) LDTP09338 1.30  LDD1446 
Omega-amidase NIT2 (NIT2) LDTP12428 1.01  LDD1446 
Parkinson disease protein 7 (PARK7) LDTP10878 0.92  LDD1446 
Peptidyl-prolyl cis-trans isomerase NIMA-interacting 1 (PIN1) LDTP05912 0.94  LDD1446 
Peripheral plasma membrane protein CASK (CASK) LDTP00482 1.20  LDD1446 
Peroxiredoxin-5, mitochondrial (PRDX5) LDTP03512 0.74; 0.83  LDD1446 
Persulfide dioxygenase ETHE1, mitochondrial (ETHE1) LDTP01633 0.94  LDD1446 
Pre-rRNA-processing protein TSR1 homolog (TSR1) LDTP14888 0.74  LDD1446 
Procollagen-lysine,2-oxoglutarate 5-dioxygenase 1 (PLOD1) LDTP05373 1.13  LDD1446 
Prostaglandin E synthase 3 (PTGES3) LDTP06338 1.19  LDD1446 
Protein arginine N-methyltransferase 1 (PRMT1) LDTP10997 0.86  LDD1446 
Protein disulfide-isomerase (P4HB) LDTP02188 0.94  LDD1446 
Protein disulfide-isomerase A3 (PDIA3) LDTP03521 0.93  LDD1446 
Protein disulfide-isomerase A4 (PDIA4) LDTP02677 0.96; 0.93  LDD1446 
Protein disulfide-isomerase A6 (PDIA6) LDTP06314 0.92  LDD1446 
Protein PML (PML) LDTP03496 2.17  LDD1446 
Protein-glutamine gamma-glutamyltransferase 2 (TGM2) LDTP03146 1.20  LDD1446 
Protein-L-isoaspartate(D-aspartate) O-methyltransferase (PCMT1) LDTP03152 0.95  LDD1446 
Pyrroline-5-carboxylate reductase 1, mitochondrial (PYCR1) LDTP03644 0.89  LDD1446 
Pyruvate carboxylase, mitochondrial (PC) LDTP02576 0.91  LDD1446 
Pyruvate kinase PKM (PKM) LDTP02733 1.04  LDD1446 
Ras-related GTP-binding protein C (RRAGC) LDTP12166 1.64  LDD1446 
Ribonuclease H2 subunit C (RNASEH2C) LDTP09446 0.92  LDD1446 
Serine--tRNA ligase, cytoplasmic (SARS1) LDTP04265 1.36  LDD1446 
Serine/threonine-protein phosphatase 2A 56 kDa regulatory subunit delta isoform (PPP2R5D) LDTP06199 1.07  LDD1446 
Serine/threonine-protein phosphatase CPPED1 (CPPED1) LDTP11107 1.36  LDD1446 
Small ribosomal subunit protein uS3 (RPS3) LDTP03223 1.16  LDD1446 
Tensin-3 (TNS3) LDTP07317 1.01  LDD1446 
Thioredoxin (TXN) LDTP02502 1.05  LDD1446 
Thioredoxin domain-containing protein 5 (TXNDC5) LDTP09067 1.00; 0.93  LDD1446 
Thymidine kinase, cytosolic (TK1) LDTP02022 1.31  LDD1446 
Tubulin alpha-1A chain (TUBA1A) LDTP07907 1.28; 1.33; 1.25  LDD1446 
Tubulin alpha-4A chain (TUBA4A) LDTP05075 1.19; 1.11; 1.16  LDD1446 
Tudor-interacting repair regulator protein (NUDT16L1) LDTP11111 1.47  LDD1446 
Ubiquitin-conjugating enzyme E2 L3 (UBE2L3) LDTP05070 2.04  LDD1446 
Uridine phosphorylase 1 (UPP1) LDTP06643 1.24  LDD1446 
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⏷ Show the Full List of 86 Enzyme
14 Transporter and channel Competed by This Competitor
Target Name Target ID Binding Ratio Interaction ID
ATP synthase subunit alpha, mitochondrial (ATP5F1A) LDTP03327 1.08  LDD1446 
Chloride intracellular channel protein 1 (CLIC1) LDTP00244 0.95  LDD1446 
Chloride intracellular channel protein 4 (CLIC4) LDTP14222 0.88  LDD1446 
Exportin-1 (XPO1) LDTP00501 0.99; 2.20  LDD1446 
Exportin-2 (CSE1L) LDTP04662 0.92  LDD1446 
Nuclear pore complex protein Nup214 (NUP214) LDTP03777 0.97  LDD1446 
Nuclear pore complex protein Nup93 (NUP93) LDTP08769 1.41  LDD1446 
Nucleoporin NUP35 (NUP35) LDTP09204 1.64  LDD1446 
Protein SEC13 homolog (SEC13) LDTP04707 1.15  LDD1446 
Signal recognition particle 9 kDa protein (SRP9) LDTP04259 0.91  LDD1446 
Small ribosomal subunit protein RACK1 (RACK1) LDTP05057 1.10  LDD1446 
Sorting nexin-6 (SNX6) LDTP13661 1.26  LDD1446 
Thioredoxin domain-containing protein 17 (TXNDC17) LDTP11103 1.06  LDD1446 
THO complex subunit 6 homolog (THOC6) LDTP08315 0.79  LDD1446 
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⏷ Show the Full List of 14 Transporter and channel
7 Transcription factor Competed by This Competitor
Target Name Target ID Binding Ratio Interaction ID
CDKN2A-interacting protein (CDKN2AIP) LDTP12792 3.51  LDD1446 
Chromatin accessibility complex protein 1 (CHRAC1) LDTP12507 3.06  LDD1446 
eIF5-mimic protein 2 (BZW1) LDTP07940 1.07  LDD1446 
Non-POU domain-containing octamer-binding protein (NONO) LDTP06341 1.03  LDD1446 
Nucleus accumbens-associated protein 1 (NACC1) LDTP10756 1.23  LDD1446 
Recombining binding protein suppressor of hairless (RBPJ) LDTP05485 1.21  LDD1446 
SWI/SNF complex subunit SMARCC2 (SMARCC2) LDTP09311 1.45  LDD1446 
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⏷ Show the Full List of 7 Transcription factor
74 Other Competed by This Competitor
Target Name Target ID Binding Ratio Interaction ID
Actin filament-associated protein 1 (AFAP1) LDTP08885 1.03  LDD1446 
Actin-related protein 2/3 complex subunit 3 (ARPC3) LDTP00552 1.00  LDD1446 
Actin-related protein 3 (ACTR3) LDTP04902 0.95  LDD1446 
Alpha-actinin-1 (ACTN1) LDTP02631 1.09  LDD1446 
Aminoacyl tRNA synthase complex-interacting multifunctional protein 2 (AIMP2) LDTP05770 1.36; 1.34  LDD1446 
Anillin (ANLN) LDTP12443 1.35  LDD1446 
Ataxin-7-like protein 3B (ATXN7L3B) LDTP15730 1.39  LDD1446 
BRISC and BRCA1-A complex member 1 (BABAM1) LDTP12737 1.37  LDD1446 
Calponin-2 (CNN2) LDTP10864 1.46; 1.46  LDD1446 
Cleavage stimulation factor subunit 2 (CSTF2) LDTP03665 1.17  LDD1446 
Cofilin-1 (CFL1) LDTP03244 0.86  LDD1446 
Coronin-1C (CORO1C) LDTP13580 1.38; 1.54  LDD1446 
Cyclin-H (CCNH) LDTP04487 1.86  LDD1446 
Cysteine and glycine-rich protein 2 (CSRP2) LDTP06542 0.84  LDD1446 
Cytoplasmic dynein 1 heavy chain 1 (DYNC1H1) LDTP06083 1.26  LDD1446 
Cytosolic iron-sulfur assembly component 2B (CIAO2B) LDTP13979 0.90  LDD1446 
Dedicator of cytokinesis protein 7 (DOCK7) LDTP10613 1.23  LDD1446 
Disks large-associated protein 5 (DLGAP5) LDTP06378 1.04  LDD1446 
DNA mismatch repair protein Msh2 (MSH2) LDTP04028 1.16  LDD1446 
EF-hand domain-containing protein D2 (EFHD2) LDTP15701 0.89  LDD1446 
Eukaryotic translation initiation factor 3 subunit M (EIF3M) LDTP07947 0.92  LDD1446 
GrpE protein homolog 1, mitochondrial (GRPEL1) LDTP12144 1.11  LDD1446 
Heat shock 70 kDa protein 4 (HSPA4) LDTP03695 1.31  LDD1446 
Heterogeneous nuclear ribonucleoprotein F (HNRNPF) LDTP04514 1.17; 0.99  LDD1446 
Heterogeneous nuclear ribonucleoprotein R (HNRNPR) LDTP00756 1.14  LDD1446 
Heterogeneous nuclear ribonucleoprotein U (HNRNPU) LDTP05259 1.30  LDD1446 
Hippocalcin-like protein 1 (HPCAL1) LDTP03841 1.21  LDD1446 
Kinetochore protein NDC80 homolog (NDC80) LDTP00431 1.33  LDD1446 
Lamina-associated polypeptide 2, isoform alpha (TMPO) LDTP03967 2.36; 1.50; 1.36  LDD1446 
LanC-like protein 2 (LANCL2) LDTP12571 1.17  LDD1446 
Large ribosomal subunit protein eL24 (RPL24) LDTP05186 1.25; 1.33  LDD1446 
Large ribosomal subunit protein eL30 (RPL30) LDTP05021 1.03  LDD1446 
Large ribosomal subunit protein uL14 (RPL23) LDTP05008 1.09  LDD1446 
Large ribosomal subunit protein uL16 (RPL10) LDTP03395 1.12  LDD1446 
Large ribosomal subunit protein uL3 (RPL3) LDTP03865 1.23  LDD1446 
Large ribosomal subunit protein uL4 (RPL4) LDTP03815 0.96  LDD1446 
Leucine-rich repeat-containing protein 41 (LRRC41) LDTP06362 1.41  LDD1446 
LIM and calponin homology domains-containing protein 1 (LIMCH1) LDTP13705 1.23  LDD1446 
Mediator of RNA polymerase II transcription subunit 15 (MED15) LDTP10771 0.96; 1.45  LDD1446 
Mediator of RNA polymerase II transcription subunit 17 (MED17) LDTP12669 1.03  LDD1446 
Mini-chromosome maintenance complex-binding protein (MCMBP) LDTP11197 1.68  LDD1446 
MOB-like protein phocein (MOB4) LDTP13964 0.91  LDD1446 
Neuroblast differentiation-associated protein AHNAK (AHNAK) LDTP05597 1.03  LDD1446 
Nuclear migration protein nudC (NUDC) LDTP13817 1.21  LDD1446 
NudC domain-containing protein 1 (NUDCD1) LDTP10781 1.25  LDD1446 
Plectin (PLEC) LDTP06330 1.62  LDD1446 
Poly(rC)-binding protein 1 (PCBP1) LDTP06366 1.06; 1.91  LDD1446 
Programmed cell death 6-interacting protein (PDCD6IP) LDTP09580 1.08  LDD1446 
Proteasome activator complex subunit 1 (PSME1) LDTP05484 1.89  LDD1446 
Protein diaphanous homolog 1 (DIAPH1) LDTP01011 0.75  LDD1446 
Protein lin-7 homolog C (LIN7C) LDTP12638 1.08  LDD1446 
Protein misato homolog 1 (MSTO1) LDTP11239 0.89  LDD1446 
Protein S100-A11 (S100A11) LDTP03620 0.84  LDD1446 
Ras GTPase-activating-like protein IQGAP1 (IQGAP1) LDTP04117 1.37  LDD1446 
Serpin H1 (SERPINH1) LDTP04363 1.24  LDD1446 
Sister chromatid cohesion protein PDS5 homolog A (PDS5A) LDTP06684 1.17  LDD1446 
Small ribosomal subunit protein eS27 (RPS27) LDTP03987 1.02  LDD1446 
Small ribosomal subunit protein eS4, X isoform (RPS4X) LDTP04997 0.82  LDD1446 
Small ribosomal subunit protein uS12 (RPS23) LDTP04971 1.32  LDD1446 
Small ribosomal subunit protein uS17 (RPS11) LDTP04975 1.05; 1.08  LDD1446 
Small ribosomal subunit protein uS7 (RPS5) LDTP04110 1.12  LDD1446 
SNW domain-containing protein 1 (SNW1) LDTP05930 1.02  LDD1446 
Stress-70 protein, mitochondrial (HSPA9) LDTP03860 0.99  LDD1446 
T-complex protein 1 subunit epsilon (CCT5) LDTP04201 1.03  LDD1446 
T-complex protein 1 subunit eta (CCT7) LDTP10990 1.18  LDD1446 
T-complex protein 1 subunit theta (CCT8) LDTP04390 0.77  LDD1446 
Targeting protein for Xklp2 (TPX2) LDTP13583 1.12  LDD1446 
TBC1 domain family member 23 (TBC1D23) LDTP12651 1.07  LDD1446 
THUMP domain-containing protein 1 (THUMPD1) LDTP12780 1.22  LDD1446 
Transcription initiation factor IIA subunit 2 (GTF2A2) LDTP04517 1.03  LDD1446 
Treacle protein (TCOF1) LDTP05867 1.34  LDD1446 
Tubulin beta chain (TUBB) LDTP02205 1.24; 1.27  LDD1446 
WD repeat and HMG-box DNA-binding protein 1 (WDHD1) LDTP01299 1.44  LDD1446 
WW domain-containing adapter protein with coiled-coil (WAC) LDTP11191 1.37  LDD1446 
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⏷ Show the Full List of 74 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 Fragment47
Competitor Concentration 500 uM
In Vitro Experiment Model Model Type
Cell lysate
Derived Tissue
Breast
Disease Model Breast adenocarcinoma [ICD-11:2C60]
Model Name Human breast adenocarcinoma cell lysate (MDA-MB-231)
Interaction Atlas ID  LDD1446  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.