Details of the Target

General Information of Target

Target ID LDTP02729
Target Name Aldo-keto reductase family 1 member A1 (AKR1A1)
Gene Name AKR1A1
Gene ID 10327
Synonyms
ALDR1; ALR; Aldo-keto reductase family 1 member A1; EC 1.1.1.2; EC 1.1.1.372; EC 1.1.1.54; Alcohol dehydrogenase [NADP(+)]; Aldehyde reductase; Glucuronate reductase; EC 1.1.1.19; Glucuronolactone reductase; EC 1.1.1.20
3D Structure
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2D Sequence (FASTA)
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3D Structure (PDB)
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Sequence
MAASCVLLHTGQKMPLIGLGTWKSEPGQVKAAVKYALSVGYRHIDCAAIYGNEPEIGEAL
KEDVGPGKAVPREELFVTSKLWNTKHHPEDVEPALRKTLADLQLEYLDLYLMHWPYAFER
GDNPFPKNADGTICYDSTHYKETWKALEALVAKGLVQALGLSNFNSRQIDDILSVASVRP
AVLQVECHPYLAQNELIAHCQARGLEVTAYSPLGSSDRAWRDPDEPVLLEEPVVLALAEK
YGRSPAQILLRWQVQRKVICIPKSITPSRILQNIKVFDFTFSPEEMKQLNALNKNWRYIV
PMLTVDGKRVPRDAGHPLYPFNDPY
Target Bioclass
Enzyme
Family
Aldo/keto reductase family
Subcellular location
Cytoplasm, cytosol
Function
Catalyzes the NADPH-dependent reduction of a wide variety of carbonyl-containing compounds to their corresponding alcohols. Displays enzymatic activity towards endogenous metabolites such as aromatic and aliphatic aldehydes, ketones, monosaccharides and bile acids, with a preference for negatively charged substrates, such as glucuronate and succinic semialdehyde. Functions as a detoxifiying enzyme by reducing a range of toxic aldehydes. Reduces methylglyoxal and 3-deoxyglucosone, which are present at elevated levels under hyperglycemic conditions and are cytotoxic. Involved also in the detoxification of lipid-derived aldehydes like acrolein. Plays a role in the activation of procarcinogens, such as polycyclic aromatic hydrocarbon trans-dihydrodiols, and in the metabolism of various xenobiotics and drugs, including the anthracyclines doxorubicin (DOX) and daunorubicin (DAUN). Displays no reductase activity towards retinoids.
Uniprot ID
P14550
Ensemble ID
ENST00000351829.9
HGNC ID
HGNC:380
ChEMBL ID
CHEMBL2246

Probe(s) Labeling This Target

ABPP Probe
Click To Hide/Show 26 Probe Related to This Target
Probe name Structure Binding Site(Ratio) Interaction ID Ref
m-APA
 Probe Info  		14.15  LDD0402  [1]
A-EBA
 Probe Info  		4.68  LDD0215  [2]
YN-1
 Probe Info  		100.00  LDD0444  [3]
Probe 1
 Probe Info  		Y35(25.26); Y210(9.92)  LDD3495  [4]
DBIA
 Probe Info  		C46(1.30)  LDD3318  [5]
BTD
 Probe Info  		C260(0.41)  LDD2104  [6]
HHS-482
 Probe Info  		Y210(2.96)  LDD0285  [7]
HHS-475
 Probe Info  		Y135(1.12)  LDD0264  [8]
HHS-465
 Probe Info  		Y210(1.95)  LDD2237  [9]
5E-2FA
 Probe Info  		H9(0.00); H139(0.00)  LDD2235  [10]
ATP probe
 Probe Info  		K127(0.00); K23(0.00)  LDD0199  [11]
4-Iodoacetamidophenylacetylene
 Probe Info  		C46(0.00); C260(0.00); C134(0.00)  LDD0038  [12]
IA-alkyne
 Probe Info  		C46(0.00); C260(0.00); C134(0.00); C187(0.00)  LDD0036  [12]
IPIAA_L
 Probe Info  		C46(0.00); C187(0.00); C134(0.00)  LDD0031  [13]
Lodoacetamide azide
 Probe Info  		C46(0.00); C260(0.00); C134(0.00)  LDD0037  [12]
IPM
 Probe Info  		C134(0.00); C5(0.00)  LDD0025  [14]
JW-RF-010
 Probe Info  		C134(0.00); C46(0.00); C5(0.00)  LDD0026  [14]
TFBX
 Probe Info  		N.A.  LDD0027  [14]
PF-06672131
 Probe Info  		N.A.  LDD0017  [15]
SF
 Probe Info  		N.A.  LDD0028  [16]
STPyne
 Probe Info  		K23(0.00); K127(0.00)  LDD0009  [17]
1c-yne
 Probe Info  		K13(0.00); K153(0.00)  LDD0228  [18]
Acrolein
 Probe Info  		C46(0.00); C134(0.00)  LDD0217  [19]
Crotonaldehyde
 Probe Info  		N.A.  LDD0219  [19]
Methacrolein
 Probe Info  		N.A.  LDD0218  [19]
NAIA_5
 Probe Info  		C46(0.00); C134(0.00); C5(0.00)  LDD2223  [20]
PAL-AfBPP Probe
Click To Hide/Show 1 Probe Related to This Target
Probe name Structure Binding Site(Ratio) Interaction ID Ref
VE-P
 Probe Info  		N.A.  LDD0396  [21]

Competitor(s) Related to This Target

Competitor ID Name Cell line Binding Site(Ratio) Interaction ID Ref
 LDCM0214  AC1 HEK-293T C134(0.95)  LDD0812  [22]
 LDCM0215  AC10 HEK-293T C134(1.05)  LDD1508  [23]
 LDCM0226  AC11 HEK-293T C134(0.98); C46(1.26); C187(1.07)  LDD1509  [23]
 LDCM0230  AC113 HEK-293T C134(1.19)  LDD0828  [22]
 LDCM0231  AC114 HEK-293T C134(0.82)  LDD0829  [22]
 LDCM0232  AC115 HEK-293T C134(0.81)  LDD0830  [22]
 LDCM0233  AC116 HEK-293T C134(0.97)  LDD0831  [22]
 LDCM0234  AC117 HEK-293T C134(0.83)  LDD0832  [22]
 LDCM0235  AC118 HEK-293T C134(1.00)  LDD0833  [22]
 LDCM0236  AC119 HEK-293T C134(1.04)  LDD0834  [22]
 LDCM0237  AC12 HEK-293T C134(0.99)  LDD1510  [23]
 LDCM0238  AC120 HEK-293T C134(0.83)  LDD0836  [22]
 LDCM0239  AC121 HEK-293T C134(1.05)  LDD0837  [22]
 LDCM0240  AC122 HEK-293T C134(1.06)  LDD0838  [22]
 LDCM0241  AC123 HEK-293T C134(1.28)  LDD0839  [22]
 LDCM0242  AC124 HEK-293T C134(0.95)  LDD0840  [22]
 LDCM0243  AC125 HEK-293T C134(1.21)  LDD0841  [22]
 LDCM0244  AC126 HEK-293T C134(1.23)  LDD0842  [22]
 LDCM0245  AC127 HEK-293T C134(1.24)  LDD0843  [22]
 LDCM0259  AC14 HEK-293T C134(1.16)  LDD1512  [23]
 LDCM0270  AC15 HEK-293T C134(1.06); C46(1.21); C200(1.04)  LDD1513  [23]
 LDCM0276  AC17 HEK-293T C134(1.39)  LDD0874  [22]
 LDCM0277  AC18 HEK-293T C134(1.16)  LDD0875  [22]
 LDCM0278  AC19 HEK-293T C134(1.03)  LDD0876  [22]
 LDCM0279  AC2 HEK-293T C134(1.05)  LDD0877  [22]
 LDCM0280  AC20 HEK-293T C134(1.33)  LDD0878  [22]
 LDCM0281  AC21 HEK-293T C134(1.28)  LDD0879  [22]
 LDCM0282  AC22 HEK-293T C134(1.36)  LDD0880  [22]
 LDCM0283  AC23 HEK-293T C134(1.34)  LDD0881  [22]
 LDCM0284  AC24 HEK-293T C134(1.13)  LDD0882  [22]
 LDCM0285  AC25 HEK-293T C134(1.01)  LDD1524  [23]
 LDCM0286  AC26 HEK-293T C134(1.03)  LDD1525  [23]
 LDCM0287  AC27 HEK-293T C134(0.88); C46(1.10); C187(0.90)  LDD1526  [23]
 LDCM0288  AC28 HEK-293T C134(1.01)  LDD1527  [23]
 LDCM0289  AC29 HEK-293T C134(1.09); C46(0.91); C187(1.05)  LDD1528  [23]
 LDCM0290  AC3 HEK-293T C134(1.18)  LDD0888  [22]
 LDCM0291  AC30 HEK-293T C134(1.03)  LDD1530  [23]
 LDCM0292  AC31 HEK-293T C134(1.07); C46(0.83); C200(0.84)  LDD1531  [23]
 LDCM0293  AC32 HEK-293T C134(1.02); C46(1.01)  LDD1532  [23]
 LDCM0294  AC33 HEK-293T C134(0.89)  LDD1533  [23]
 LDCM0295  AC34 HEK-293T C134(0.97)  LDD1534  [23]
 LDCM0296  AC35 HEK-293T C134(1.03); C46(0.94); C187(0.93)  LDD1535  [23]
 LDCM0297  AC36 HEK-293T C134(0.95)  LDD1536  [23]
 LDCM0298  AC37 HEK-293T C134(1.14); C46(1.26); C187(1.00)  LDD1537  [23]
 LDCM0299  AC38 HEK-293T C134(1.18)  LDD1538  [23]
 LDCM0300  AC39 HEK-293T C134(1.02); C46(1.05); C200(1.28)  LDD1539  [23]
 LDCM0301  AC4 HEK-293T C134(0.93)  LDD0899  [22]
 LDCM0302  AC40 HEK-293T C134(0.93); C46(1.07)  LDD1541  [23]
 LDCM0303  AC41 HEK-293T C134(1.00)  LDD1542  [23]
 LDCM0304  AC42 HEK-293T C134(0.91)  LDD1543  [23]
 LDCM0305  AC43 HEK-293T C134(0.97); C46(1.14); C187(0.89)  LDD1544  [23]
 LDCM0306  AC44 HEK-293T C134(0.91)  LDD1545  [23]
 LDCM0307  AC45 HEK-293T C134(1.03); C46(1.30); C187(1.22)  LDD1546  [23]
 LDCM0308  AC46 HEK-293T C134(1.10)  LDD0906  [22]
 LDCM0309  AC47 HEK-293T C134(1.01)  LDD0907  [22]
 LDCM0310  AC48 HEK-293T C134(1.05)  LDD0908  [22]
 LDCM0311  AC49 HEK-293T C134(1.13)  LDD0909  [22]
 LDCM0312  AC5 HEK-293T C134(0.78)  LDD0910  [22]
 LDCM0313  AC50 HEK-293T C134(0.99)  LDD0911  [22]
 LDCM0314  AC51 HEK-293T C134(1.17)  LDD0912  [22]
 LDCM0315  AC52 HEK-293T C134(1.00)  LDD0913  [22]
 LDCM0316  AC53 HEK-293T C134(0.92)  LDD0914  [22]
 LDCM0317  AC54 HEK-293T C134(1.21)  LDD0915  [22]
 LDCM0318  AC55 HEK-293T C134(1.22)  LDD0916  [22]
 LDCM0319  AC56 HEK-293T C134(1.15)  LDD0917  [22]
 LDCM0320  AC57 HEK-293T C134(0.82)  LDD0918  [22]
 LDCM0321  AC58 HEK-293T C134(0.78)  LDD0919  [22]
 LDCM0322  AC59 HEK-293T C134(0.83)  LDD0920  [22]
 LDCM0323  AC6 HEK-293T C134(0.99)  LDD1562  [23]
 LDCM0324  AC60 HEK-293T C134(0.95)  LDD0922  [22]
 LDCM0325  AC61 HEK-293T C134(0.97)  LDD0923  [22]
 LDCM0326  AC62 HEK-293T C134(0.77)  LDD0924  [22]
 LDCM0327  AC63 HEK-293T C134(0.81)  LDD0925  [22]
 LDCM0328  AC64 HEK-293T C134(0.75)  LDD0926  [22]
 LDCM0329  AC65 HEK-293T C134(0.96)  LDD0927  [22]
 LDCM0330  AC66 HEK-293T C134(0.91)  LDD0928  [22]
 LDCM0331  AC67 HEK-293T C134(0.90)  LDD0929  [22]
 LDCM0334  AC7 HEK-293T C134(1.11); C46(1.04); C200(1.21)  LDD1568  [23]
 LDCM0345  AC8 HEK-293T C134(0.89); C46(1.05)  LDD1569  [23]
 LDCM0248  AKOS034007472 HEK-293T C134(1.11); C46(1.03); C187(1.27)  LDD1511  [23]
 LDCM0356  AKOS034007680 HEK-293T C134(0.95)  LDD1570  [23]
 LDCM0275  AKOS034007705 HEK-293T C134(0.93); C46(0.99)  LDD1514  [23]
 LDCM0108  Chloroacetamide HeLa C46(0.00); C134(0.00)  LDD0222  [19]
 LDCM0632  CL-Sc Hep-G2 C5(1.01)  LDD2227  [20]
 LDCM0367  CL1 HEK-293T C134(0.93)  LDD1571  [23]
 LDCM0368  CL10 HEK-293T C134(1.07)  LDD1572  [23]
 LDCM0369  CL100 HEK-293T C134(1.23)  LDD0967  [22]
 LDCM0370  CL101 HEK-293T C134(0.97)  LDD1574  [23]
 LDCM0371  CL102 HEK-293T C134(0.91); C187(0.90)  LDD1575  [23]
 LDCM0372  CL103 HEK-293T C134(1.15); C187(1.07)  LDD1576  [23]
 LDCM0373  CL104 HEK-293T C134(0.94); C46(1.15)  LDD1577  [23]
 LDCM0374  CL105 HEK-293T C134(1.10)  LDD0972  [22]
 LDCM0375  CL106 HEK-293T C134(1.64)  LDD0973  [22]
 LDCM0376  CL107 HEK-293T C134(1.08)  LDD0974  [22]
 LDCM0377  CL108 HEK-293T C134(1.16)  LDD0975  [22]
 LDCM0378  CL109 HEK-293T C134(1.29)  LDD0976  [22]
 LDCM0379  CL11 HEK-293T C134(0.97); C46(1.16); C200(0.67)  LDD1583  [23]
 LDCM0380  CL110 HEK-293T C134(1.41)  LDD0978  [22]
 LDCM0381  CL111 HEK-293T C134(1.21)  LDD0979  [22]
 LDCM0382  CL112 HEK-293T C134(1.02); C46(1.09)  LDD1586  [23]
 LDCM0383  CL113 HEK-293T C134(1.01)  LDD1587  [23]
 LDCM0384  CL114 HEK-293T C134(0.90); C187(0.97)  LDD1588  [23]
 LDCM0385  CL115 HEK-293T C134(1.04); C187(0.98)  LDD1589  [23]
 LDCM0386  CL116 HEK-293T C134(0.90); C46(0.98)  LDD1590  [23]
 LDCM0387  CL117 HEK-293T C134(0.99)  LDD1591  [23]
 LDCM0388  CL118 HEK-293T C134(1.01); C187(0.99)  LDD1592  [23]
 LDCM0389  CL119 HEK-293T C134(0.99); C187(0.96)  LDD1593  [23]
 LDCM0390  CL12 HEK-293T C134(0.85); C46(1.00)  LDD1594  [23]
 LDCM0391  CL120 HEK-293T C134(0.97); C46(1.57)  LDD1595  [23]
 LDCM0392  CL121 HEK-293T C134(1.28)  LDD0990  [22]
 LDCM0393  CL122 HEK-293T C134(1.11)  LDD0991  [22]
 LDCM0394  CL123 HEK-293T C134(1.17)  LDD0992  [22]
 LDCM0395  CL124 HEK-293T C134(1.17)  LDD0993  [22]
 LDCM0396  CL125 HEK-293T C134(0.96)  LDD0994  [22]
 LDCM0397  CL126 HEK-293T C134(1.01)  LDD0995  [22]
 LDCM0398  CL127 HEK-293T C134(0.83)  LDD0996  [22]
 LDCM0399  CL128 HEK-293T C134(0.97)  LDD0997  [22]
 LDCM0400  CL13 HEK-293T C134(0.84)  LDD1604  [23]
 LDCM0401  CL14 HEK-293T C134(1.00); C187(1.04)  LDD1605  [23]
 LDCM0402  CL15 HEK-293T C134(0.95); C187(0.84)  LDD1606  [23]
 LDCM0403  CL16 HEK-293T C134(0.92); C46(1.18)  LDD1607  [23]
 LDCM0404  CL17 HEK-293T C134(0.89)  LDD1608  [23]
 LDCM0405  CL18 HEK-293T C134(1.01)  LDD1609  [23]
 LDCM0406  CL19 HEK-293T C134(1.02); C46(0.95); C187(0.80)  LDD1610  [23]
 LDCM0407  CL2 HEK-293T C134(0.95); C187(0.92)  LDD1611  [23]
 LDCM0408  CL20 HEK-293T C134(1.00)  LDD1612  [23]
 LDCM0409  CL21 HEK-293T C134(0.94); C46(1.30); C187(0.74)  LDD1613  [23]
 LDCM0410  CL22 HEK-293T C134(1.05)  LDD1614  [23]
 LDCM0411  CL23 HEK-293T C134(1.13); C46(1.07); C200(0.81)  LDD1615  [23]
 LDCM0412  CL24 HEK-293T C134(0.85); C46(1.01)  LDD1616  [23]
 LDCM0413  CL25 HEK-293T C134(0.92)  LDD1617  [23]
 LDCM0414  CL26 HEK-293T C134(1.12); C187(0.96)  LDD1618  [23]
 LDCM0415  CL27 HEK-293T C134(1.03); C187(0.92)  LDD1619  [23]
 LDCM0416  CL28 HEK-293T C134(1.03); C46(1.30)  LDD1620  [23]
 LDCM0417  CL29 HEK-293T C134(1.07)  LDD1621  [23]
 LDCM0418  CL3 HEK-293T C134(1.07); C187(1.01)  LDD1622  [23]
 LDCM0419  CL30 HEK-293T C134(1.07)  LDD1623  [23]
 LDCM0420  CL31 HEK-293T C134(0.96); C46(0.67); C187(0.83)  LDD1624  [23]
 LDCM0421  CL32 HEK-293T C134(0.96)  LDD1625  [23]
 LDCM0422  CL33 HEK-293T C134(0.92); C46(1.00); C187(0.71)  LDD1626  [23]
 LDCM0423  CL34 HEK-293T C134(0.96)  LDD1627  [23]
 LDCM0424  CL35 HEK-293T C134(1.03); C46(1.07); C200(0.66)  LDD1628  [23]
 LDCM0425  CL36 HEK-293T C134(0.90); C46(1.11)  LDD1629  [23]
 LDCM0426  CL37 HEK-293T C134(0.94)  LDD1630  [23]
 LDCM0428  CL39 HEK-293T C134(1.14); C187(0.88)  LDD1632  [23]
 LDCM0429  CL4 HEK-293T C134(0.83); C46(0.91)  LDD1633  [23]
 LDCM0430  CL40 HEK-293T C134(0.95); C46(1.11)  LDD1634  [23]
 LDCM0431  CL41 HEK-293T C134(0.91)  LDD1635  [23]
 LDCM0432  CL42 HEK-293T C134(1.03)  LDD1636  [23]
 LDCM0433  CL43 HEK-293T C134(0.93); C46(1.23); C187(1.21)  LDD1637  [23]
 LDCM0434  CL44 HEK-293T C134(0.92)  LDD1638  [23]
 LDCM0435  CL45 HEK-293T C134(0.96); C46(1.17); C187(0.80)  LDD1639  [23]
 LDCM0436  CL46 HEK-293T C134(1.09)  LDD1034  [22]
 LDCM0437  CL47 HEK-293T C134(1.05)  LDD1035  [22]
 LDCM0438  CL48 HEK-293T C134(1.13)  LDD1036  [22]
 LDCM0439  CL49 HEK-293T C134(1.03)  LDD1037  [22]
 LDCM0440  CL5 HEK-293T C134(0.92)  LDD1644  [23]
 LDCM0441  CL50 HEK-293T C134(1.29)  LDD1039  [22]
 LDCM0442  CL51 HEK-293T C134(1.40)  LDD1040  [22]
 LDCM0443  CL52 HEK-293T C134(0.89)  LDD1041  [22]
 LDCM0444  CL53 HEK-293T C134(1.61)  LDD1042  [22]
 LDCM0445  CL54 HEK-293T C134(1.11)  LDD1043  [22]
 LDCM0446  CL55 HEK-293T C134(0.94)  LDD1044  [22]
 LDCM0447  CL56 HEK-293T C134(0.67)  LDD1045  [22]
 LDCM0448  CL57 HEK-293T C134(0.96)  LDD1046  [22]
 LDCM0449  CL58 HEK-293T C134(1.32)  LDD1047  [22]
 LDCM0450  CL59 HEK-293T C134(1.15)  LDD1048  [22]
 LDCM0451  CL6 HEK-293T C134(0.84)  LDD1654  [23]
 LDCM0452  CL60 HEK-293T C134(1.24)  LDD1050  [22]
 LDCM0453  CL61 HEK-293T C134(0.91)  LDD1656  [23]
 LDCM0454  CL62 HEK-293T C134(0.99); C187(0.88)  LDD1657  [23]
 LDCM0455  CL63 HEK-293T C134(1.06); C187(0.99)  LDD1658  [23]
 LDCM0456  CL64 HEK-293T C134(0.86); C46(1.10)  LDD1659  [23]
 LDCM0457  CL65 HEK-293T C134(0.95)  LDD1660  [23]
 LDCM0458  CL66 HEK-293T C134(0.93)  LDD1661  [23]
 LDCM0459  CL67 HEK-293T C134(1.01); C46(0.88); C187(0.86)  LDD1662  [23]
 LDCM0460  CL68 HEK-293T C134(0.96)  LDD1663  [23]
 LDCM0461  CL69 HEK-293T C134(1.03); C46(1.18); C187(0.86)  LDD1664  [23]
 LDCM0462  CL7 HEK-293T C134(0.89); C46(0.81); C187(0.90)  LDD1665  [23]
 LDCM0463  CL70 HEK-293T C134(1.05)  LDD1666  [23]
 LDCM0464  CL71 HEK-293T C134(1.03); C46(1.02); C200(0.74)  LDD1667  [23]
 LDCM0465  CL72 HEK-293T C134(0.87); C46(1.34)  LDD1668  [23]
 LDCM0466  CL73 HEK-293T C134(0.94)  LDD1669  [23]
 LDCM0467  CL74 HEK-293T C134(0.95); C187(1.24)  LDD1670  [23]
 LDCM0469  CL76 HEK-293T C134(0.96); C46(1.16)  LDD1672  [23]
 LDCM0470  CL77 HEK-293T C134(0.91)  LDD1673  [23]
 LDCM0471  CL78 HEK-293T C134(1.00)  LDD1674  [23]
 LDCM0472  CL79 HEK-293T C134(0.96); C46(1.02); C187(1.00)  LDD1675  [23]
 LDCM0473  CL8 HEK-293T C134(0.70)  LDD1676  [23]
 LDCM0474  CL80 HEK-293T C134(1.02)  LDD1677  [23]
 LDCM0475  CL81 HEK-293T C134(1.06); C46(1.24); C187(0.92)  LDD1678  [23]
 LDCM0476  CL82 HEK-293T C134(1.01)  LDD1679  [23]
 LDCM0477  CL83 HEK-293T C134(0.98); C46(0.81); C200(0.86)  LDD1680  [23]
 LDCM0478  CL84 HEK-293T C134(0.85); C46(0.93)  LDD1681  [23]
 LDCM0479  CL85 HEK-293T C134(0.90)  LDD1682  [23]
 LDCM0480  CL86 HEK-293T C134(0.98); C187(1.22)  LDD1683  [23]
 LDCM0481  CL87 HEK-293T C134(0.89); C187(1.30)  LDD1684  [23]
 LDCM0482  CL88 HEK-293T C134(0.82); C46(0.91)  LDD1685  [23]
 LDCM0483  CL89 HEK-293T C134(0.85)  LDD1686  [23]
 LDCM0484  CL9 HEK-293T C134(0.95); C46(1.04); C187(0.85)  LDD1687  [23]
 LDCM0485  CL90 HEK-293T C134(0.81)  LDD1688  [23]
 LDCM0486  CL91 HEK-293T C134(0.97)  LDD1084  [22]
 LDCM0487  CL92 HEK-293T C134(1.02)  LDD1085  [22]
 LDCM0488  CL93 HEK-293T C134(1.08)  LDD1086  [22]
 LDCM0489  CL94 HEK-293T C134(1.09)  LDD1087  [22]
 LDCM0490  CL95 HEK-293T C134(1.58)  LDD1088  [22]
 LDCM0491  CL96 HEK-293T C134(1.11)  LDD1089  [22]
 LDCM0492  CL97 HEK-293T C134(1.06)  LDD1090  [22]
 LDCM0493  CL98 HEK-293T C134(1.08)  LDD1091  [22]
 LDCM0494  CL99 HEK-293T C134(1.03)  LDD1092  [22]
 LDCM0634  CY-0357 Hep-G2 C5(0.80)  LDD2228  [20]
 LDCM0495  E2913 HEK-293T C134(1.18); C187(1.02)  LDD1698  [23]
 LDCM0625  F8 Ramos C46(0.73)  LDD2187  [24]
 LDCM0572  Fragment10 Ramos C46(0.50)  LDD2189  [24]
 LDCM0573  Fragment11 Ramos C134(0.94); C46(1.14)  LDD2190  [24]
 LDCM0574  Fragment12 Ramos C46(0.56)  LDD2191  [24]
 LDCM0575  Fragment13 Ramos C46(0.64)  LDD2192  [24]
 LDCM0576  Fragment14 Ramos C134(0.81); C46(0.61)  LDD2193  [24]
 LDCM0579  Fragment20 Ramos C46(0.44)  LDD2194  [24]
 LDCM0580  Fragment21 Ramos C46(0.69)  LDD2195  [24]
 LDCM0582  Fragment23 Ramos C46(1.47)  LDD2196  [24]
 LDCM0578  Fragment27 Ramos C46(1.04)  LDD2197  [24]
 LDCM0586  Fragment28 Ramos C134(1.66)  LDD2198  [24]
 LDCM0588  Fragment30 Ramos C46(0.83)  LDD2199  [24]
 LDCM0589  Fragment31 Ramos C46(1.27)  LDD2200  [24]
 LDCM0590  Fragment32 Ramos C46(0.56)  LDD2201  [24]
 LDCM0468  Fragment33 HEK-293T C134(0.96); C187(1.17)  LDD1671  [23]
 LDCM0596  Fragment38 Ramos C46(1.09)  LDD2203  [24]
 LDCM0566  Fragment4 Ramos C134(0.85); C46(0.72)  LDD2184  [24]
 LDCM0427  Fragment51 HEK-293T C134(1.14); C187(0.91)  LDD1631  [23]
 LDCM0610  Fragment52 Ramos C46(0.91)  LDD2204  [24]
 LDCM0614  Fragment56 Ramos C46(0.88)  LDD2205  [24]
 LDCM0569  Fragment7 Ramos C134(0.78); C46(0.56)  LDD2186  [24]
 LDCM0571  Fragment9 Ramos C46(0.39)  LDD2188  [24]
 LDCM0116  HHS-0101 DM93 Y135(1.12)  LDD0264  [8]
 LDCM0117  HHS-0201 DM93 Y135(4.30)  LDD0265  [8]
 LDCM0118  HHS-0301 DM93 Y135(1.68)  LDD0266  [8]
 LDCM0119  HHS-0401 DM93 Y135(9.15)  LDD0267  [8]
 LDCM0120  HHS-0701 DM93 Y135(2.12)  LDD0268  [8]
 LDCM0107  IAA HeLa N.A.  LDD0221  [19]
 LDCM0123  JWB131 DM93 Y210(2.96)  LDD0285  [7]
 LDCM0124  JWB142 DM93 Y210(1.03)  LDD0286  [7]
 LDCM0125  JWB146 DM93 Y210(1.22)  LDD0287  [7]
 LDCM0126  JWB150 DM93 Y210(1.72)  LDD0288  [7]
 LDCM0127  JWB152 DM93 Y210(1.00)  LDD0289  [7]
 LDCM0128  JWB198 DM93 Y210(1.14)  LDD0290  [7]
 LDCM0129  JWB202 DM93 Y210(0.44)  LDD0291  [7]
 LDCM0130  JWB211 DM93 Y210(1.29)  LDD0292  [7]
 LDCM0022  KB02 HEK-293T C134(1.06)  LDD1492  [23]
 LDCM0023  KB03 HEK-293T C134(1.05)  LDD1497  [23]
 LDCM0024  KB05 MELHO C46(1.30)  LDD3318  [5]
 LDCM0109  NEM HeLa H86(0.00); H316(0.00)  LDD0223  [19]
 LDCM0511  Nucleophilic fragment 18b MDA-MB-231 C260(0.41)  LDD2104  [6]
 LDCM0628  OTUB2-COV-1 HEK-293T C5(0.45)  LDD2207  [25]

The Interaction Atlas With This Target

The Protein(s) Related To This Target

Transporter and channel
Click To Hide/Show 2 Protein(s) Interacting with This Target
Protein name Family Uniprot ID
Huntingtin (HTT) Huntingtin family P42858
Wolframin (WFS1) . O76024
Transcription factor
Click To Hide/Show 1 Protein(s) Interacting with This Target
Protein name Family Uniprot ID
Telomeric repeat-binding factor 2-interacting protein 1 (TERF2IP) RAP1 family Q9NYB0

The Drug(s) Related To This Target

Approved
Click To Hide/Show 7 Drug(s) Interacting with This Target
Drug Name Drug Type External ID
Certolizumab Pegol BiotechDrug DB08904
Doxorubicin Small molecular drug DB00997
Ethanol Small molecular drug DB00898
Lumateperone Small molecular drug DB06077
Nadh Small molecular drug DB00157
Silodosin Small molecular drug DB06207
Copper . DB09130
Investigative
Click To Hide/Show 1 Drug(s) Interacting with This Target
Drug Name Drug Type External ID
Nicotinamide Adenine Dinucleotide Phosphate . DB03461
Discontinued
Click To Hide/Show 1 Drug(s) Interacting with This Target
Drug Name Drug Type External ID
Tolrestat Small molecular drug DB02383

References

1 Quantitative and Site-Specific Chemoproteomic Profiling of Targets of Acrolein. Chem Res Toxicol. 2019 Mar 18;32(3):467-473. doi: 10.1021/acs.chemrestox.8b00343. Epub 2019 Jan 15.
2 2-Ethynylbenzaldehyde-Based, Lysine-Targeting Irreversible Covalent Inhibitors for Protein Kinases and Nonkinases. J Am Chem Soc. 2023 Feb 12. doi: 10.1021/jacs.2c11595. Online ahead of print.
Mass spectrometry data entry: PXD037665
3 Ynamide Electrophile for the Profiling of Ligandable Carboxyl Residues in Live Cells and the Development of New Covalent Inhibitors. J Med Chem. 2022 Aug 11;65(15):10408-10418. doi: 10.1021/acs.jmedchem.2c00272. Epub 2022 Jul 26.
4 An Azo Coupling-Based Chemoproteomic Approach to Systematically Profile the Tyrosine Reactivity in the Human Proteome. Anal Chem. 2021 Jul 27;93(29):10334-10342. doi: 10.1021/acs.analchem.1c01935. Epub 2021 Jul 12.
5 DrugMap: A quantitative pan-cancer analysis of cysteine ligandability. Cell. 2024 May 9;187(10):2536-2556.e30. doi: 10.1016/j.cell.2024.03.027. Epub 2024 Apr 22.
Mass spectrometry data entry: PXD047840
6 Nucleophilic covalent ligand discovery for the cysteine redoxome. Nat Chem Biol. 2023 Nov;19(11):1309-1319. doi: 10.1038/s41589-023-01330-5. Epub 2023 May 29.
Mass spectrometry data entry: PXD039908 , PXD029761
7 Chemoproteomic profiling of kinases in live cells using electrophilic sulfonyl triazole probes. Chem Sci. 2021 Jan 21;12(9):3295-3307. doi: 10.1039/d0sc06623k.
8 Discovery of a Cell-Active SuTEx Ligand of Prostaglandin Reductase 2. Chembiochem. 2021 Jun 15;22(12):2134-2139. doi: 10.1002/cbic.202000879. Epub 2021 Apr 29.
9 Global targeting of functional tyrosines using sulfur-triazole exchange chemistry. Nat Chem Biol. 2020 Feb;16(2):150-159. doi: 10.1038/s41589-019-0404-5. Epub 2019 Nov 25.
10 Global profiling of functional histidines in live cells using small-molecule photosensitizer and chemical probe relay labelling. Nat Chem. 2024 Jun 4. doi: 10.1038/s41557-024-01545-6. Online ahead of print.
Mass spectrometry data entry: PXD042377
11 Targeted Proteomic Approaches for Proteome-Wide Characterizations of the AMP-Binding Capacities of Kinases. J Proteome Res. 2022 Aug 5;21(8):2063-2070. doi: 10.1021/acs.jproteome.2c00225. Epub 2022 Jul 12.
12 Enhancing Cysteine Chemoproteomic Coverage through Systematic Assessment of Click Chemistry Product Fragmentation. Anal Chem. 2022 Mar 8;94(9):3800-3810. doi: 10.1021/acs.analchem.1c04402. Epub 2022 Feb 23.
Mass spectrometry data entry: PXD028853
13 SP3-Enabled Rapid and High Coverage Chemoproteomic Identification of Cell-State-Dependent Redox-Sensitive Cysteines. Mol Cell Proteomics. 2022 Apr;21(4):100218. doi: 10.1016/j.mcpro.2022.100218. Epub 2022 Feb 25.
Mass spectrometry data entry: PXD029500 , PXD031647
14 Chemoproteomic Profiling by Cysteine Fluoroalkylation Reveals Myrocin G as an Inhibitor of the Nonhomologous End Joining DNA Repair Pathway. J Am Chem Soc. 2021 Dec 8;143(48):20332-20342. doi: 10.1021/jacs.1c09724. Epub 2021 Nov 24.
Mass spectrometry data entry: PXD029255
15 Site-Specific Activity-Based Protein Profiling Using Phosphonate Handles. Mol Cell Proteomics. 2023 Jan;22(1):100455. doi: 10.1016/j.mcpro.2022.100455. Epub 2022 Nov 24.
Mass spectrometry data entry: PXD036569
16 Solid Phase Synthesis of Fluorosulfate Containing Macrocycles for Chemoproteomic Workflows. bioRxiv [Preprint]. 2023 Feb 18:2023.02.17.529022. doi: 10.1101/2023.02.17.529022.
Mass spectrometry data entry: PXD039931
17 A modification-centric assessment tool for the performance of chemoproteomic probes. Nat Chem Biol. 2022 Aug;18(8):904-912. doi: 10.1038/s41589-022-01074-8. Epub 2022 Jul 21.
Mass spectrometry data entry: PXD027758 , PXD027755 , PXD027760 , PXD027762 , PXD027756 , PXD027591 , PXD007149 , PXD030064 , PXD032392 , PXD027789 , PXD027767 , PXD027764
18 Tunable Amine-Reactive Electrophiles for Selective Profiling of Lysine. Angew Chem Int Ed Engl. 2022 Jan 26;61(5):e202112107. doi: 10.1002/anie.202112107. Epub 2021 Dec 16.
19 ACR-Based Probe for the Quantitative Profiling of Histidine Reactivity in the Human Proteome. J Am Chem Soc. 2023 Mar 8;145(9):5252-5260. doi: 10.1021/jacs.2c12653. Epub 2023 Feb 27.
20 N-Acryloylindole-alkyne (NAIA) enables imaging and profiling new ligandable cysteines and oxidized thiols by chemoproteomics. Nat Commun. 2023 Jun 15;14(1):3564. doi: 10.1038/s41467-023-39268-w.
Mass spectrometry data entry: PXD041264
21 Pharmacological Targeting of Vacuolar H(+)-ATPase via Subunit V1G Combats Multidrug-Resistant Cancer. Cell Chem Biol. 2020 Nov 19;27(11):1359-1370.e8. doi: 10.1016/j.chembiol.2020.06.011. Epub 2020 Jul 9.
22 Reimagining high-throughput profiling of reactive cysteines for cell-based screening of large electrophile libraries. Nat Biotechnol. 2021 May;39(5):630-641. doi: 10.1038/s41587-020-00778-3. Epub 2021 Jan 4.
23 Accelerating multiplexed profiling of protein-ligand interactions: High-throughput plate-based reactive cysteine profiling with minimal input. Cell Chem Biol. 2024 Mar 21;31(3):565-576.e4. doi: 10.1016/j.chembiol.2023.11.015. Epub 2023 Dec 19.
Mass spectrometry data entry: PXD044402
24 Site-specific quantitative cysteine profiling with data-independent acquisition-based mass spectrometry. Methods Enzymol. 2023;679:295-322. doi: 10.1016/bs.mie.2022.07.037. Epub 2022 Sep 7.
Mass spectrometry data entry: PXD027578
25 Rapid Covalent-Probe Discovery by Electrophile-Fragment Screening. J Am Chem Soc. 2019 Jun 5;141(22):8951-8968. doi: 10.1021/jacs.9b02822. Epub 2019 May 22.