Details of the Probe

General Information of Probe

Probe ID
LDPC0406
Probe Name
C166
Synonyms
Z3433406333
Probe Type
PAL-AfBPP Probe
Structure
2D MOL
Ro5 Violations (Lipinski): 0 Molecular Weight (mw) 385.4
Lipid-water partition coefficient (xlogp) 2.9
Rotatable Bond Count (rotbonds) 7
Hydrogen Bond Donor Count (hbonddonor) 1
Hydrogen Bond Acceptor Count (hbondacc) 5
Chemical Identifiers
Formula
C22H19N5O2
IUPAC Name
N-[2-(3-but-3-ynyldiazirin-3-yl)ethyl]-4-(4-oxoquinazolin-3-yl)benzamide
Canonical SMILES
C#CCCC1(N=N1)CCNC(=O)C2=CC=C(C=C2)N3C=NC4=CC=CC=C4C3=O
InChI
InChI=1S/C22H19N5O2/c1-2-3-12-22(25-26-22)13-14-23-20(28)16-8-10-17(11-9-16)27-15-24-19-7-5-4-6-18(19)21(27)29/h1,4-11,15H,3,12-14H2,(H,23,28)
InChIKey
GEPLQQKBZJCYJK-UHFFFAOYSA-N

The Probe Interaction Atlas

Target(s) List of this Probe

84 Enzyme Labeled by This Probe
Target Name Target ID Binding Site(Ratio) Interaction ID
3-beta-hydroxysteroid-Delta(8),Delta(7)-isomerase (EBP) LDTP06325 9.99  LDD1846 
3-ketodihydrosphingosine reductase (KDSR) LDTP05476 12.04  LDD1846 
Acetyl-CoA acetyltransferase, cytosolic (ACAT2) LDTP11321 6.63  LDD1846 
Adenosine kinase (ADK) LDTP04689 11.63  LDD1846 
ADP-dependent glucokinase (ADPGK) LDTP11127 9.85  LDD1846 
Aldehyde dehydrogenase family 3 member A2 (ALDH3A2) LDTP04437 7.01  LDD1846 
Arginyl-tRNA--protein transferase 1 (ATE1) LDTP14534 9.58  LDD1846 
ATP-dependent translocase ABCB1 (ABCB1) LDTP02254 8.75  LDD1846 
Beta-glucuronidase (GUSB) LDTP02260 7.16  LDD1846 
C-terminal-binding protein 1 (CTBP1) LDTP05842 6.73  LDD1846 
CAAX prenyl protease 1 homolog (ZMPSTE24) LDTP01328 8.28  LDD1846 
Carbohydrate sulfotransferase 14 (CHST14) LDTP09096 7.46  LDD1846 
Carnitine O-palmitoyltransferase 2, mitochondrial (CPT2) LDTP03257 16.68  LDD1846 
Catechol O-methyltransferase (COMT) LDTP03145 6.87  LDD1846 
CDGSH iron-sulfur domain-containing protein 1 (CISD1) LDTP12873 10.85  LDD1846 
Ceramide synthase 1 (CERS1) LDTP03394 7.62  LDD1846 
Ceramide synthase 2 (CERS2) LDTP10329 12.55  LDD1846 
COP9 signalosome complex subunit 6 (COPS6) LDTP07966 7.26  LDD1846 
Corrinoid adenosyltransferase MMAB (MMAB) LDTP10286 10.13  LDD1846 
Cytochrome b-c1 complex subunit 8 (UQCRQ) LDTP00486 11.96  LDD1846 
Cytochrome b-c1 complex subunit 9 (UQCR10) LDTP13189 10.06  LDD1846 
Cytochrome b5 type B (CYB5B) LDTP00697 14.93  LDD1846 
Cytochrome P450 20A1 (CYP20A1) LDTP17410 9.25  LDD1846 
dCTP pyrophosphatase 1 (DCTPP1) LDTP12013 16.00  LDD1846 
Delta(14)-sterol reductase LBR (LBR) LDTP06200 8.40  LDD1846 
Delta(24)-sterol reductase (DHCR24) LDTP06375 12.21  LDD1846 
Delta(3,5)-Delta(2,4)-dienoyl-CoA isomerase, mitochondrial (ECH1) LDTP05724 8.00  LDD1846 
Dolichyl-diphosphooligosaccharide--protein glycosyltransferase subunit STT3A (STT3A) LDTP04120 7.94  LDD1846 
Endoplasmic reticulum metallopeptidase 1 (ERMP1) LDTP08017 7.11  LDD1846 
Endoplasmic reticulum transmembrane helix translocase (ATP13A1) LDTP12279 9.51  LDD1846 
Endothelin-converting enzyme 1 (ECE1) LDTP04008 11.00  LDD1846 
Epoxide hydrolase 1 (EPHX1) LDTP02175 10.34  LDD1846 
Fumarylacetoacetase (FAH) LDTP02868 8.88  LDD1846 
Glutamate dehydrogenase 1, mitochondrial (GLUD1) LDTP01768 11.24  LDD1846 
Glutamyl-tRNA(Gln) amidotransferase subunit A, mitochondrial (QRSL1) LDTP11728 6.87  LDD1846 
Glycerol-3-phosphate acyltransferase 1, mitochondrial (GPAM) LDTP12253 9.92  LDD1846 
Heme oxygenase 1 (HMOX1) LDTP02359 6.68  LDD1846 
Heme oxygenase 2 (HMOX2) LDTP03540 8.94  LDD1846 
Inactive hydroxysteroid dehydrogenase-like protein 1 (HSDL1) LDTP06787 10.85  LDD1846 
Lanosterol 14-alpha demethylase (CYP51A1) LDTP06648 28.84  LDD1846 
Lanosterol synthase (LSS) LDTP04183 8.00  LDD1846 
Leucyl-cystinyl aminopeptidase (LNPEP) LDTP13358 6.82  LDD1846 
Leukotriene A-4 hydrolase (LTA4H) LDTP02385 52.71  LDD1846 
Lysophosphatidic acid phosphatase type 6 (ACP6) LDTP12363 10.56  LDD1846 
Lysophospholipid acyltransferase 7 (MBOAT7) LDTP10612 9.71  LDD1846 
Lysosomal Pro-X carboxypeptidase (PRCP) LDTP04004 8.51  LDD1846 
Methionine aminopeptidase 1 (METAP1) LDTP04565 6.54  LDD1846 
Minor histocompatibility antigen H13 (HM13) LDTP09396 6.92  LDD1846 
NADH dehydrogenase 1 beta subcomplex subunit 3 (NDUFB3) LDTP00832 8.63  LDD1846 
NADH dehydrogenase iron-sulfur protein 2, mitochondrial (NDUFS2) LDTP01168 17.03  LDD1846 
NADPH--cytochrome P450 reductase (POR) LDTP02848 6.82  LDD1846 
Nardilysin (NRDC) LDTP00886 9.19  LDD1846 
Palmitoyl-protein thioesterase ABHD10, mitochondrial (ABHD10) LDTP12628 8.88  LDD1846 
Peptidyl-prolyl cis-trans isomerase FKBP14 (FKBP14) LDTP12720 9.45  LDD1846 
Peptidyl-prolyl cis-trans isomerase FKBP1A (FKBP1A) LDTP05029 9.32  LDD1846 
Peripheral plasma membrane protein CASK (CASK) LDTP00482 6.59  LDD1846 
Peroxisomal acyl-coenzyme A oxidase 1 (ACOX1) LDTP06307 6.96  LDD1846 
Peroxisomal acyl-coenzyme A oxidase 3 (ACOX3) LDTP00589 9.58  LDD1846 
Peroxisomal trans-2-enoyl-CoA reductase (PECR) LDTP11437 7.21  LDD1846 
Phosphatidylinositol 3-kinase catalytic subunit type 3 (PIK3C3) LDTP09155 33.36  LDD1846 
Phospholipase A2 group XV (PLA2G15) LDTP09088 8.51  LDD1846 
Pirin (PIR) LDTP00325 9.06  LDD1846 
Prenylcysteine oxidase 1 (PCYOX1) LDTP13282 7.94  LDD1846 
Prolyl 3-hydroxylase 1 (P3H1) LDTP06750 7.62  LDD1846 
Prostaglandin E synthase 2 (PTGES2) LDTP12040 7.67  LDD1846 
Prostaglandin reductase 3 (PTGR3) LDTP15422 11.63  LDD1846 
Proteasome subunit beta type-4 (PSMB4) LDTP03417 9.13  LDD1846 
Proteasome subunit beta type-7 (PSMB7) LDTP10862 6.77  LDD1846 
Protein-S-isoprenylcysteine O-methyltransferase (ICMT) LDTP01039 20.53  LDD1846 
Puromycin-sensitive aminopeptidase (NPEPPS) LDTP04712 13.09  LDD1846 
RAC-beta serine/threonine-protein kinase (AKT2) LDTP03608 8.82  LDD1846 
Reticulon-4-interacting protein 1, mitochondrial (RTN4IP1) LDTP09666 7.67  LDD1846 
Retinal rod rhodopsin-sensitive cGMP 3',5'-cyclic phosphodiesterase subunit delta (PDE6D) LDTP00907 15.24  LDD1846 
S-adenosylhomocysteine hydrolase-like protein 1 (AHCYL1) LDTP00890 7.16  LDD1846 
S-methyl-5'-thioadenosine phosphorylase (MTAP) LDTP05758 8.51  LDD1846 
Saccharopine dehydrogenase-like oxidoreductase (SCCPDH) LDTP15484 6.73  LDD1846 
Sarcoplasmic/endoplasmic reticulum calcium ATPase 2 (ATP2A2) LDTP02860 7.01  LDD1846 
Serum paraoxonase/arylesterase 2 (PON2) LDTP06333 12.04  LDD1846 
SET and MYND domain-containing protein 4 (SMYD4) LDTP08664 20.25  LDD1846 
Signal peptidase complex catalytic subunit SEC11A (SEC11A) LDTP05066 7.16  LDD1846 
Squalene synthase (FDFT1) LDTP03842 26.35  LDD1846 
Stearoyl-CoA desaturase (SCD) LDTP00344 7.84  LDD1846 
Ubiquitin-conjugating enzyme E2 G2 (UBE2G2) LDTP04874 10.06  LDD1846 
V-type proton ATPase 116 kDa subunit a 2 (ATP6V0A2) LDTP14030 13.74  LDD1846 
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⏷ Show the Full List of 84 Enzyme
57 Transporter and channel Labeled by This Probe
Target Name Target ID Binding Site(Ratio) Interaction ID
Adenosine 3'-phospho 5'-phosphosulfate transporter 1 (SLC35B2) LDTP09328 9.19  LDD1846 
Amyloid-beta precursor protein (APP) LDTP02071 6.59  LDD1846 
ATP synthase subunit g, mitochondrial (ATP5MG) LDTP14511 9.65  LDD1846 
BRI3-binding protein (BRI3BP) LDTP15648 7.89  LDD1846 
Cytoskeleton-associated protein 4 (CKAP4) LDTP05511 6.54  LDD1846 
Derlin-1 (DERL1) LDTP11245 7.01  LDD1846 
ER lumen protein-retaining receptor 1 (KDELR1) LDTP03277 7.57  LDD1846 
High affinity cationic amino acid transporter 1 (SLC7A1) LDTP03559 9.45  LDD1846 
Importin-4 (IPO4) LDTP09515 6.73  LDD1846 
Lysosome membrane protein 2 (SCARB2) LDTP06034 12.55  LDD1846 
Magnesium transporter NIPA3 (NIPAL1) LDTP17362 12.55  LDD1846 
Melanoma inhibitory activity protein 2 (MIA2) LDTP10669 7.01  LDD1846 
Metaxin-1 (MTX1) LDTP05900 14.03  LDD1846 
Metaxin-2 (MTX2) LDTP01217 10.41  LDD1846 
Mitochondrial 2-oxoglutarate/malate carrier protein (SLC25A11) LDTP05384 7.06  LDD1846 
Mitochondrial carnitine/acylcarnitine carrier protein (SLC25A20) LDTP00865 8.06  LDD1846 
Mitochondrial carrier homolog 1 (MTCH1) LDTP12909 8.22  LDD1846 
Mitochondrial dicarboxylate carrier (SLC25A10) LDTP13174 9.38  LDD1846 
Mitochondrial import inner membrane translocase subunit Tim10 (TIMM10) LDTP04956 7.94  LDD1846 
Mitochondrial import inner membrane translocase subunit Tim17-A (TIMM17A) LDTP10913 34.54  LDD1846 
Mitochondrial import inner membrane translocase subunit Tim17-B (TIMM17B) LDTP01059 25.28  LDD1846 
Mitochondrial inner membrane protein OXA1L (OXA1L) LDTP06308 9.99  LDD1846 
Mitochondrial S-adenosylmethionine carrier protein (SLC25A26) LDTP07885 12.13  LDD1846 
Mpv17-like protein 2 (MPV17L2) LDTP14952 7.01  LDD1846 
NPC intracellular cholesterol transporter 1 (NPC1) LDTP00541 7.31  LDD1846 
Nucleoporin NDC1 (NDC1) LDTP11213 7.94  LDD1846 
PAT complex subunit CCDC47 (CCDC47) LDTP10059 6.96  LDD1846 
Peroxisomal membrane protein 2 (PXMP2) LDTP16069 7.16  LDD1846 
Peroxisomal membrane protein PEX14 (PEX14) LDTP01200 7.67  LDD1846 
Prosaposin (PSAP) LDTP02215 7.94  LDD1846 
Protein FAM8A1 (FAM8A1) LDTP16190 7.41  LDD1846 
Protein GPR107 (GPR107) LDTP07236 13.74  LDD1846 
Protein GPR108 (GPR108) LDTP12383 13.64  LDD1846 
Putative divalent cation/proton antiporter TMEM165 (TMEM165) LDTP12207 7.67  LDD1846 
Putative lipid scramblase CLPTM1 (CLPTM1) LDTP01745 8.88  LDD1846 
Scavenger receptor class B member 1 (SCARB1) LDTP09547 12.91  LDD1846 
Sigma intracellular receptor 2 (TMEM97) LDTP06945 8.22  LDD1846 
Sigma non-opioid intracellular receptor 1 (SIGMAR1) LDTP10958 9.71  LDD1846 
Solute carrier family 25 member 32 (SLC25A32) LDTP11813 16.00  LDD1846 
Solute carrier family 35 member F2 (SLC35F2) LDTP17641 7.57  LDD1846 
STARD3 N-terminal-like protein (STARD3NL) LDTP01671 7.16  LDD1846 
Syntaxin-5 (STX5) LDTP05780 6.54  LDD1846 
Tetraspanin-3 (TSPAN3) LDTP16813 7.46  LDD1846 
Translocating chain-associated membrane protein 1 (TRAM1) LDTP06426 6.77  LDD1846 
Translocon-associated protein subunit alpha (SSR1) LDTP04033 12.13  LDD1846 
Transmembrane 9 superfamily member 3 (TM9SF3) LDTP18448 10.93  LDD1846 
Transmembrane protein 104 (TMEM104) LDTP17797 6.68  LDD1846 
Transmembrane protein 126A (TMEM126A) LDTP15948 11.63  LDD1846 
Transmembrane protein 160 (TMEM160) LDTP20002 14.32  LDD1846 
Transmembrane protein 199 (TMEM199) LDTP08881 10.27  LDD1846 
Transmembrane protein 201 (TMEM201) LDTP07058 6.82  LDD1846 
Transmembrane protein 205 (TMEM205) LDTP07667 11.63  LDD1846 
Transmembrane protein 230 (TMEM230) LDTP10065 7.36  LDD1846 
V-type proton ATPase 116 kDa subunit a 1 (ATP6V0A1) LDTP09968 13.09  LDD1846 
Vang-like protein 1 (VANGL1) LDTP09288 7.21  LDD1846 
Voltage-dependent anion-selective channel protein 1 (VDAC1) LDTP03132 22.01  LDD1846 
Voltage-dependent anion-selective channel protein 2 (VDAC2) LDTP04071 16.00  LDD1846 
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⏷ Show the Full List of 57 Transporter and channel
49 Other Labeled by This Probe
Target Name Target ID Binding Site(Ratio) Interaction ID
Ankyrin repeat and LEM domain-containing protein 2 (ANKLE2) LDTP08364 13.45  LDD1846 
Apolipoprotein L2 (APOL2) LDTP11076 23.92  LDD1846 
Calumenin (CALU) LDTP00887 7.57  LDD1846 
Centrosomal protein 43 (CEP43) LDTP01652 6.87  LDD1846 
Cleavage stimulation factor subunit 1 (CSTF1) LDTP14812 6.87  LDD1846 
Clustered mitochondria protein homolog (CLUH) LDTP14486 16.91  LDD1846 
Cytochrome c oxidase assembly factor 3 homolog, mitochondrial (COA3) LDTP13902 7.67  LDD1846 
Endoplasmic reticulum-Golgi intermediate compartment protein 2 (ERGIC2) LDTP10775 7.78  LDD1846 
Endoplasmic reticulum-Golgi intermediate compartment protein 3 (ERGIC3) LDTP13828 10.06  LDD1846 
Eukaryotic translation initiation factor 3 subunit E (EIF3E) LDTP04853 11.16  LDD1846 
Golgi integral membrane protein 4 (GOLIM4) LDTP00281 14.42  LDD1846 
Heterogeneous nuclear ribonucleoprotein A/B (HNRNPAB) LDTP10962 6.96  LDD1846 
Heterogeneous nuclear ribonucleoprotein D-like (HNRNPDL) LDTP00500 8.40  LDD1846 
Heterogeneous nuclear ribonucleoprotein F (HNRNPF) LDTP04514 6.87  LDD1846 
Heterogeneous nuclear ribonucleoprotein H (HNRNPH1) LDTP03615 8.00  LDD1846 
Heterogeneous nuclear ribonucleoprotein H2 (HNRNPH2) LDTP04714 6.63  LDD1846 
Heterogeneous nuclear ribonucleoprotein Q (SYNCRIP) LDTP00991 7.41  LDD1846 
Heterogeneous nuclear ribonucleoprotein R (HNRNPR) LDTP00756 7.16  LDD1846 
Large proline-rich protein BAG6 (BAG6) LDTP04094 16.56  LDD1846 
Large ribosomal subunit protein eL42 (RPL36A) LDTP05188 11.16  LDD1846 
MAGUK p55 subfamily member 2 (MPP2) LDTP06068 8.11  LDD1846 
Mitochondrial calcium uniporter regulator 1 (MCUR1) LDTP10093 13.27  LDD1846 
Mitochondrial fission process protein 1 (MTFP1) LDTP16192 8.46  LDD1846 
Mitochondrial import receptor subunit TOM22 homolog (TOMM22) LDTP12565 19.16  LDD1846 
Mitochondrial import receptor subunit TOM5 homolog (TOMM5) LDTP15420 9.38  LDD1846 
Negative elongation factor C/D (NELFCD) LDTP08594 8.17  LDD1846 
Neuferricin (CYB5D2) LDTP15623 10.06  LDD1846 
Nucleobindin-1 (NUCB1) LDTP05375 7.21  LDD1846 
Oxysterol-binding protein-related protein 6 (OSBPL6) LDTP11533 8.57  LDD1846 
Peroxisomal membrane protein 11C (PEX11G) LDTP10381 7.41  LDD1846 
Protein FAM114A2 (FAM114A2) LDTP16080 7.94  LDD1846 
Protein unc-119 homolog A (UNC119) LDTP05868 11.31  LDD1846 
Protein unc-119 homolog B (UNC119B) LDTP00105 30.91  LDD1846 
Reticulocalbin-2 (RCN2) LDTP06097 8.17  LDD1846 
Reticulon-3 (RTN3) LDTP01522 9.51  LDD1846 
Reticulon-4 (RTN4) LDTP12412 12.82  LDD1846 
Rho GTPase-activating protein 17 (ARHGAP17) LDTP07335 10.85  LDD1846 
RNA-binding protein FUS (FUS) LDTP03775 6.96  LDD1846 
RNA-binding protein with multiple splicing (RBPMS) LDTP09970 8.46  LDD1846 
Sororin (CDCA5) LDTP10304 7.52  LDD1846 
Spermatogenesis-defective protein 39 homolog (VIPAS39) LDTP12091 20.53  LDD1846 
Syntaxin-18 (STX18) LDTP13086 8.46  LDD1846 
TATA-binding protein-associated factor 2N (TAF15) LDTP09881 8.94  LDD1846 
Testis-expressed protein 264 (TEX264) LDTP14259 8.06  LDD1846 
Tetratricopeptide repeat protein 38 (TTC38) LDTP19372 7.67  LDD1846 
Thioredoxin-related transmembrane protein 4 (TMX4) LDTP18373 15.03  LDD1846 
TraB domain-containing protein (TRABD) LDTP19963 7.11  LDD1846 
Ubiquinol-cytochrome c reductase complex assembly factor 6 (UQCC6) LDTP15067 9.00  LDD1846 
Uncharacterized protein KIAA2013 (KIAA2013) LDTP17652 7.31  LDD1846 
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⏷ Show the Full List of 49 Other

Full Information of The Labelling Profiles of This Probe

Quantification: AfBPP Probe vs Negative Probe
  
Experiment 1 Reporting the Labelling Profiles of This Probe
REF [1]
Probe concentration
Probe:50uM; negative probe:50uM
Quantitative Method
TMT
In Vitro Experiment Model
Model Type
Living cell
Derived Tissue
Peripheral blood
Disease Model
Normal
Model Name
Human normal cells (HEK-293T)
Note
Negative probe:C#CCCC1(CCC(NC)=O)N=N1
Interaction Atlas ID
 LDD1846 
Download The Altas

References

1 Large-scale chemoproteomics expedites ligand discovery and predicts ligand behavior in cells. Science. 2024 Apr 26;384(6694):eadk5864. doi: 10.1126/science.adk5864. Epub 2024 Apr 26.
Mass spectrometry data entry: PXD041587