Details of the Target

General Information of Target

Target ID	LDTP03842
Target Name	Squalene synthase (FDFT1)
Gene Name	FDFT1
Gene ID	2222
Synonyms	Squalene synthase; SQS; SS; EC 2.5.1.21; FPP:FPP farnesyltransferase; Farnesyl-diphosphate farnesyltransferase; Farnesyl-diphosphate farnesyltransferase 1
3D Structure	Download 2D Sequence (FASTA) Download 3D Structure (PDB) Download
Sequence	MEFVKCLGHPEEFYNLVRFRIGGKRKVMPKMDQDSLSSSLKTCYKYLNQTSRSFAAVIQA LDGEMRNAVCIFYLVLRALDTLEDDMTISVEKKVPLLHNFHSFLYQPDWRFMESKEKDRQ VLEDFPTISLEFRNLAEKYQTVIADICRRMGIGMAEFLDKHVTSEQEWDKYCHYVAGLVG IGLSRLFSASEFEDPLVGEDTERANSMGLFLQKTNIIRDYLEDQQGGREFWPQEVWSRYV KKLGDFAKPENIDLAVQCLNELITNALHHIPDVITYLSRLRNQSVFNFCAIPQVMAIATL AACYNNQQVFKGAVKIRKGQAVTLMMDATNMPAVKAIIYQYMEEIYHRIPDSDPSSSKTR QIISTIRTQNLPNCQLISRSHYSPIYLSFVMLLAALSWQYLTTLSQVTEDYVQTGEH
Target Type	Discontinued
Target Bioclass	Enzyme
Family	Phytoene/squalene synthase family
Subcellular location	Endoplasmic reticulum membrane
Function	Catalyzes the condensation of 2 farnesyl pyrophosphate (FPP) moieties to form squalene. Proceeds in two distinct steps. In the first half-reaction, two molecules of FPP react to form the stable presqualene diphosphate intermediate (PSQPP), with concomitant release of a proton and a molecule of inorganic diphosphate. In the second half-reaction, PSQPP undergoes heterolysis, isomerization, and reduction with NADPH or NADH to form squalene. It is the first committed enzyme of the sterol biosynthesis pathway.
TTD ID	T81850
Uniprot ID	P37268
DrugMap ID	TTFQEO5
Ensemble ID	ENST00000220584.9
HGNC ID	HGNC:3629
ChEMBL ID	CHEMBL3338

Target Site Mutations in Different Cell Lines

Cell line	Mutation details	Probe for labeling this protein in this cell
CAL120	SNV: p.N330Y	DBIA Probe Info
CCK81	SNV: p.N205S	DBIA Probe Info
SBC5	SNV: p.S89T	DBIA Probe Info
TOV21G	SNV: p.Q33K	DBIA Probe Info

Probe(s) Labeling This Target

ABPP Probe

Click To Hide/Show 30 Probe Related to This Target

Probe name	Binding Site(Ratio)	Interaction ID	Ref
m-APA Probe Info	13.82	LDD0402	[1]
ILS-1 Probe Info	3.60	LDD0415	[2]
TH211 Probe Info	Y14(6.18); Y346(12.19); Y46(9.11)	LDD0260	[3]
YN-4 Probe Info	100.00	LDD0445	[4]
BTD Probe Info	C374(8.26)	LDD1699	[5]
HPAP Probe Info	3.13	LDD0063	[6]
Alkyne-RA190 Probe Info	2.06	LDD0300	[7]
DBIA Probe Info	C374(0.97)	LDD0078	[8]
ATP probe Probe Info	K318(0.00); K5(0.00)	LDD0199	[9]
4-Iodoacetamidophenylacetylene Probe Info	C6(0.00); C172(0.00); C70(0.00); C374(0.00)	LDD0038	[10]
IA-alkyne Probe Info	C6(0.00); C172(0.00); C70(0.00); C374(0.00)	LDD0036	[10]
Lodoacetamide azide Probe Info	C6(0.00); C172(0.00); C70(0.00); C374(0.00)	LDD0037	[10]
IPM Probe Info	N.A.	LDD0025	[11]
JW-RF-010 Probe Info	C374(0.00); C6(0.00)	LDD0026	[11]
NAIA_4 Probe Info	N.A.	LDD2226	[12]
TFBX Probe Info	C374(0.00); C6(0.00)	LDD0027	[11]
WYneN Probe Info	N.A.	LDD0021	[13]
WYneO Probe Info	N.A.	LDD0022	[13]
Compound 10 Probe Info	C374(0.00); C6(0.00)	LDD2216	[14]
Compound 11 Probe Info	C374(0.00); C6(0.00)	LDD2213	[14]
ENE Probe Info	N.A.	LDD0006	[13]
PPMS Probe Info	N.A.	LDD0008	[13]
VSF Probe Info	N.A.	LDD0007	[13]
Phosphinate-6 Probe Info	C6(0.00); C374(0.00)	LDD0018	[15]
Acrolein Probe Info	C147(0.00); C374(0.00)	LDD0217	[16]
Crotonaldehyde Probe Info	N.A.	LDD0219	[16]
Methacrolein Probe Info	N.A.	LDD0218	[16]
W1 Probe Info	N.A.	LDD0236	[17]
AOyne Probe Info	13.10	LDD0443	[18]
NAIA_5 Probe Info	C6(0.00); C172(0.00); C258(0.00); C43(0.00)	LDD2223	[12]

PAL-AfBPP Probe

Click To Hide/Show 92 Probe Related to This Target

Probe name	Binding Site(Ratio)	Interaction ID	Ref
PARPYnD Probe Info	1.52	LDD0374	[19]
C003 Probe Info	14.93	LDD1713	[20]
C004 Probe Info	7.06	LDD1714	[20]
C017 Probe Info	8.46	LDD1725	[20]
C022 Probe Info	15.89	LDD1728	[20]
C040 Probe Info	15.45	LDD1740	[20]
C041 Probe Info	19.43	LDD1741	[20]
C044 Probe Info	9.06	LDD1743	[20]
C052 Probe Info	7.57	LDD1750	[20]
C055 Probe Info	56.49	LDD1752	[20]
C056 Probe Info	21.11	LDD1753	[20]
C060 Probe Info	7.36	LDD1757	[20]
C063 Probe Info	22.94	LDD1760	[20]
C070 Probe Info	15.67	LDD1766	[20]
C072 Probe Info	19.56	LDD1768	[20]
C087 Probe Info	14.12	LDD1779	[20]
C092 Probe Info	24.93	LDD1783	[20]
C094 Probe Info	25.46	LDD1785	[20]
C100 Probe Info	6.68	LDD1789	[20]
C107 Probe Info	19.97	LDD1794	[20]
C112 Probe Info	41.93	LDD1799	[20]
C121 Probe Info	4.96	LDD1807	[20]
C135 Probe Info	9.51	LDD1817	[20]
C139 Probe Info	32.67	LDD1821	[20]
C140 Probe Info	11.16	LDD1822	[20]
C142 Probe Info	5.35	LDD1824	[20]
C153 Probe Info	18.00	LDD1834	[20]
C158 Probe Info	20.39	LDD1838	[20]
C160 Probe Info	11.08	LDD1840	[20]
C161 Probe Info	25.99	LDD1841	[20]
C166 Probe Info	26.35	LDD1846	[20]
C169 Probe Info	30.70	LDD1849	[20]
C173 Probe Info	8.51	LDD1853	[20]
C177 Probe Info	7.46	LDD1856	[20]
C182 Probe Info	7.89	LDD1860	[20]
C187 Probe Info	55.33	LDD1865	[20]
C194 Probe Info	18.25	LDD1870	[20]
C198 Probe Info	15.45	LDD1874	[20]
C201 Probe Info	32.22	LDD1877	[20]
C215 Probe Info	5.82	LDD1889	[20]
C216 Probe Info	6.92	LDD1890	[20]
C220 Probe Info	20.68	LDD1894	[20]
C228 Probe Info	29.86	LDD1901	[20]
C240 Probe Info	13.64	LDD1913	[20]
C252 Probe Info	30.70	LDD1925	[20]
C270 Probe Info	6.02	LDD1940	[20]
C282 Probe Info	14.62	LDD1952	[20]
C297 Probe Info	6.19	LDD1967	[20]
C304 Probe Info	9.25	LDD1973	[20]
C322 Probe Info	12.30	LDD1988	[20]
C338 Probe Info	11.63	LDD2001	[20]
C339 Probe Info	27.10	LDD2002	[20]
C342 Probe Info	18.51	LDD2004	[20]
C347 Probe Info	5.43	LDD2008	[20]
C348 Probe Info	27.67	LDD2009	[20]
C350 Probe Info	45.25	LDD2011	[20]
C351 Probe Info	9.00	LDD2012	[20]
C353 Probe Info	5.86	LDD2014	[20]
C354 Probe Info	37.27	LDD2015	[20]
C355 Probe Info	29.86	LDD2016	[20]
C356 Probe Info	12.13	LDD2017	[20]
C357 Probe Info	11.88	LDD2018	[20]
C361 Probe Info	82.14	LDD2022	[20]
C364 Probe Info	15.03	LDD2025	[20]
C370 Probe Info	7.62	LDD2031	[20]
C373 Probe Info	8.51	LDD2033	[20]
C374 Probe Info	7.21	LDD2034	[20]
C382 Probe Info	18.00	LDD2041	[20]
C383 Probe Info	20.82	LDD2042	[20]
C388 Probe Info	38.32	LDD2047	[20]
C390 Probe Info	30.70	LDD2049	[20]
C391 Probe Info	14.52	LDD2050	[20]
C396 Probe Info	4.92	LDD2055	[20]
C403 Probe Info	17.27	LDD2061	[20]
C405 Probe Info	6.59	LDD2063	[20]
C407 Probe Info	12.64	LDD2064	[20]
C413 Probe Info	12.38	LDD2069	[20]
C420 Probe Info	13.55	LDD2075	[20]
C426 Probe Info	34.06	LDD2081	[20]
C429 Probe Info	12.13	LDD2084	[20]
FFF probe11 Probe Info	20.00	LDD0471	[21]
FFF probe13 Probe Info	20.00	LDD0475	[21]
FFF probe15 Probe Info	20.00	LDD0478	[21]
FFF probe2 Probe Info	20.00	LDD0463	[21]
FFF probe3 Probe Info	20.00	LDD0464	[21]
FFF probe6 Probe Info	20.00	LDD0482	[21]
FFF probe7 Probe Info	20.00	LDD0483	[21]
JN0003 Probe Info	20.00	LDD0469	[21]
STS-2 Probe Info	N.A.	LDD0138	[22]
VE-P Probe Info	N.A.	LDD0396	[23]
A-DA Probe Info	2.46	LDD0145	[24]
OEA-DA Probe Info	18.71	LDD0046	[25]

Competitor(s) Related to This Target

Competitor ID	Name	Cell line	Binding Site(Ratio)	Interaction ID	Ref
LDCM0524	2-Cyano-N-(2-morpholin-4-yl-ethyl)-acetamide	MDA-MB-231	C374(1.04); C147(1.27)	LDD2117	[5]
LDCM0558	2-Cyano-N-phenylacetamide	MDA-MB-231	C374(1.00)	LDD2152	[5]
LDCM0563	Abegg_cp(+)-11	HeLa	C147(2.09)	LDD0314	[11]
LDCM0561	Abegg_cp(-)-10	HeLa	C147(2.73)	LDD0312	[11]
LDCM0214	AC1	HCT 116	C147(0.51); C374(0.93); C6(0.98)	LDD0531	[8]
LDCM0215	AC10	HCT 116	C147(0.60); C374(1.14); C70(0.91)	LDD0532	[8]
LDCM0216	AC100	HCT 116	C147(0.81); C374(1.07)	LDD0533	[8]
LDCM0217	AC101	HCT 116	C147(0.65); C374(1.45)	LDD0534	[8]
LDCM0218	AC102	HCT 116	C147(0.70); C374(1.21)	LDD0535	[8]
LDCM0219	AC103	HCT 116	C147(0.65); C374(1.24)	LDD0536	[8]
LDCM0220	AC104	HCT 116	C147(0.65); C374(0.96)	LDD0537	[8]
LDCM0221	AC105	HCT 116	C147(0.67); C374(1.09)	LDD0538	[8]
LDCM0222	AC106	HCT 116	C147(0.59); C374(1.33)	LDD0539	[8]
LDCM0223	AC107	HCT 116	C147(0.59); C374(1.25)	LDD0540	[8]
LDCM0224	AC108	HCT 116	C147(0.75); C374(1.22)	LDD0541	[8]
LDCM0225	AC109	HCT 116	C147(0.67); C374(1.02)	LDD0542	[8]
LDCM0226	AC11	HCT 116	C147(0.54); C374(1.14); C70(0.71)	LDD0543	[8]
LDCM0227	AC110	HCT 116	C147(0.69); C374(1.09)	LDD0544	[8]
LDCM0228	AC111	HCT 116	C147(0.74); C374(0.91)	LDD0545	[8]
LDCM0229	AC112	HCT 116	C147(0.57); C374(1.09)	LDD0546	[8]
LDCM0230	AC113	HCT 116	C147(1.41); C374(1.13); C70(1.09)	LDD0547	[8]
LDCM0231	AC114	HCT 116	C147(0.89); C374(1.18); C70(0.99)	LDD0548	[8]
LDCM0232	AC115	HCT 116	C147(0.67); C374(1.07); C70(0.81)	LDD0549	[8]
LDCM0233	AC116	HCT 116	C147(0.82); C374(1.22); C70(0.93)	LDD0550	[8]
LDCM0234	AC117	HCT 116	C147(0.89); C374(1.32); C70(0.91)	LDD0551	[8]
LDCM0235	AC118	HCT 116	C147(1.00); C374(1.01); C70(0.95)	LDD0552	[8]
LDCM0236	AC119	HCT 116	C147(0.86); C374(1.27); C70(0.78)	LDD0553	[8]
LDCM0237	AC12	HCT 116	C147(0.82); C374(1.09); C70(0.81)	LDD0554	[8]
LDCM0238	AC120	HCT 116	C147(0.93); C374(1.07); C70(0.51)	LDD0555	[8]
LDCM0239	AC121	HCT 116	C147(1.31); C374(1.06); C70(0.99)	LDD0556	[8]
LDCM0240	AC122	HCT 116	C147(0.77); C374(1.53); C70(0.84)	LDD0557	[8]
LDCM0241	AC123	HCT 116	C147(1.13); C374(0.98); C70(1.00)	LDD0558	[8]
LDCM0242	AC124	HCT 116	C147(1.03); C374(1.02); C70(1.08)	LDD0559	[8]
LDCM0243	AC125	HCT 116	C147(1.04); C374(1.17); C70(1.19)	LDD0560	[8]
LDCM0244	AC126	HCT 116	C147(0.76); C374(1.32); C70(0.86)	LDD0561	[8]
LDCM0245	AC127	HCT 116	C147(0.67); C374(1.22); C70(0.99)	LDD0562	[8]
LDCM0246	AC128	HCT 116	C374(1.18)	LDD0563	[8]
LDCM0247	AC129	HCT 116	C374(1.00)	LDD0564	[8]
LDCM0249	AC130	HCT 116	C374(1.47)	LDD0566	[8]
LDCM0250	AC131	HCT 116	C374(1.01)	LDD0567	[8]
LDCM0251	AC132	HCT 116	C374(1.10)	LDD0568	[8]
LDCM0252	AC133	HCT 116	C374(1.32)	LDD0569	[8]
LDCM0253	AC134	HCT 116	C374(1.42)	LDD0570	[8]
LDCM0254	AC135	HCT 116	C374(1.13)	LDD0571	[8]
LDCM0255	AC136	HCT 116	C374(1.08)	LDD0572	[8]
LDCM0256	AC137	HCT 116	C374(1.14)	LDD0573	[8]
LDCM0257	AC138	HCT 116	C374(1.16)	LDD0574	[8]
LDCM0258	AC139	HCT 116	C374(1.24)	LDD0575	[8]
LDCM0259	AC14	HCT 116	C147(0.65); C374(1.16); C70(0.84)	LDD0576	[8]
LDCM0260	AC140	HCT 116	C374(1.38)	LDD0577	[8]
LDCM0261	AC141	HCT 116	C374(1.29)	LDD0578	[8]
LDCM0262	AC142	HCT 116	C374(0.99)	LDD0579	[8]
LDCM0263	AC143	HCT 116	C374(1.11); C70(1.03)	LDD0580	[8]
LDCM0264	AC144	HCT 116	C70(0.98); C374(1.22)	LDD0581	[8]
LDCM0265	AC145	HCT 116	C70(1.04); C374(1.12)	LDD0582	[8]
LDCM0266	AC146	HCT 116	C70(0.83); C374(1.25)	LDD0583	[8]
LDCM0267	AC147	HCT 116	C70(0.91); C374(1.21)	LDD0584	[8]
LDCM0268	AC148	HCT 116	C70(0.82); C374(1.55)	LDD0585	[8]
LDCM0269	AC149	HCT 116	C70(0.87); C374(1.38)	LDD0586	[8]
LDCM0270	AC15	HCT 116	C147(0.63); C70(0.81); C374(1.03)	LDD0587	[8]
LDCM0271	AC150	HCT 116	C70(0.89); C374(1.12)	LDD0588	[8]
LDCM0272	AC151	HCT 116	C70(0.99); C374(1.18)	LDD0589	[8]
LDCM0273	AC152	HCT 116	C70(0.76); C374(1.12)	LDD0590	[8]
LDCM0274	AC153	HCT 116	C70(0.80); C374(1.48)	LDD0591	[8]
LDCM0621	AC154	HCT 116	C374(1.09); C70(0.99)	LDD2158	[8]
LDCM0622	AC155	HCT 116	C374(1.10); C70(0.90)	LDD2159	[8]
LDCM0623	AC156	HCT 116	C374(1.04); C70(1.07)	LDD2160	[8]
LDCM0624	AC157	HCT 116	C374(1.22); C70(1.29)	LDD2161	[8]
LDCM0276	AC17	HCT 116	C70(0.98); C374(1.09)	LDD0593	[8]
LDCM0277	AC18	HCT 116	C70(0.74); C374(1.05)	LDD0594	[8]
LDCM0278	AC19	HCT 116	C70(0.98); C374(1.10)	LDD0595	[8]
LDCM0279	AC2	HCT 116	C147(0.72); C6(0.93); C374(0.95)	LDD0596	[8]
LDCM0280	AC20	HCT 116	C70(1.12); C374(1.14)	LDD0597	[8]
LDCM0281	AC21	HCT 116	C70(0.80); C374(0.99)	LDD0598	[8]
LDCM0282	AC22	HCT 116	C374(1.07); C70(1.11)	LDD0599	[8]
LDCM0283	AC23	HCT 116	C70(1.10); C374(1.11)	LDD0600	[8]
LDCM0284	AC24	HCT 116	C374(1.06); C70(1.12)	LDD0601	[8]
LDCM0285	AC25	HCT 116	C147(0.86); C374(1.07)	LDD0602	[8]
LDCM0286	AC26	HCT 116	C147(0.82); C374(1.35)	LDD0603	[8]
LDCM0287	AC27	HCT 116	C147(0.82); C374(1.14)	LDD0604	[8]
LDCM0288	AC28	HCT 116	C147(0.79); C374(1.01)	LDD0605	[8]
LDCM0289	AC29	HCT 116	C147(0.90); C374(1.04)	LDD0606	[8]
LDCM0290	AC3	HCT 116	C147(0.87); C6(0.89); C374(0.98)	LDD0607	[8]
LDCM0291	AC30	HCT 116	C147(0.94); C374(1.18)	LDD0608	[8]
LDCM0292	AC31	HCT 116	C374(0.99); C147(1.07)	LDD0609	[8]
LDCM0293	AC32	HCT 116	C147(0.90); C374(1.25)	LDD0610	[8]
LDCM0294	AC33	HCT 116	C147(0.96); C374(1.10)	LDD0611	[8]
LDCM0295	AC34	HCT 116	C147(0.79); C374(1.18)	LDD0612	[8]
LDCM0296	AC35	HCT 116	C70(0.78); C374(0.88); C147(1.40)	LDD0613	[8]
LDCM0297	AC36	HCT 116	C374(0.89); C147(1.12); C70(1.47)	LDD0614	[8]
LDCM0298	AC37	HCT 116	C374(0.89); C147(1.14); C70(1.53)	LDD0615	[8]
LDCM0299	AC38	HCT 116	C374(1.05); C147(1.18); C70(1.19)	LDD0616	[8]
LDCM0300	AC39	HCT 116	C70(0.81); C374(0.94); C147(1.10)	LDD0617	[8]
LDCM0301	AC4	HCT 116	C147(0.58); C6(1.04); C374(1.12)	LDD0618	[8]
LDCM0302	AC40	HCT 116	C147(0.85); C374(1.10); C70(1.27)	LDD0619	[8]
LDCM0303	AC41	HCT 116	C147(1.08); C374(1.09); C70(1.21)	LDD0620	[8]
LDCM0304	AC42	HCT 116	C374(0.92); C147(0.94); C70(1.31)	LDD0621	[8]
LDCM0305	AC43	HCT 116	C147(0.87); C70(1.07); C374(1.09)	LDD0622	[8]
LDCM0306	AC44	HCT 116	C374(0.95); C147(0.99); C70(1.05)	LDD0623	[8]
LDCM0307	AC45	HCT 116	C147(0.81); C70(0.83); C374(0.97)	LDD0624	[8]
LDCM0308	AC46	HCT 116	C147(0.86); C70(0.94); C374(0.97)	LDD0625	[8]
LDCM0309	AC47	HCT 116	C70(0.88); C147(0.92); C374(1.05)	LDD0626	[8]
LDCM0310	AC48	HCT 116	C147(0.79); C70(1.06); C374(1.07)	LDD0627	[8]
LDCM0311	AC49	HCT 116	C70(0.66); C147(0.76); C374(1.14)	LDD0628	[8]
LDCM0312	AC5	HCT 116	C147(0.62); C6(0.90); C374(1.05)	LDD0629	[8]
LDCM0313	AC50	HCT 116	C147(0.68); C70(0.91); C374(1.13)	LDD0630	[8]
LDCM0314	AC51	HCT 116	C147(1.05); C374(1.06); C70(1.14)	LDD0631	[8]
LDCM0315	AC52	HCT 116	C147(0.93); C374(1.06); C70(1.06)	LDD0632	[8]
LDCM0316	AC53	HCT 116	C147(0.81); C374(0.89); C70(0.92)	LDD0633	[8]
LDCM0317	AC54	HCT 116	C70(0.75); C147(0.86); C374(1.03)	LDD0634	[8]
LDCM0318	AC55	HCT 116	C147(0.73); C70(0.93); C374(1.22)	LDD0635	[8]
LDCM0319	AC56	HCT 116	C147(0.58); C70(0.89); C374(1.17)	LDD0636	[8]
LDCM0320	AC57	HCT 116	C147(0.76); C70(1.04); C6(1.12); C374(1.25)	LDD0637	[8]
LDCM0321	AC58	HCT 116	C147(0.74); C70(1.08); C6(1.25); C374(1.29)	LDD0638	[8]
LDCM0322	AC59	HCT 116	C147(0.86); C70(1.08); C6(1.22); C374(1.27)	LDD0639	[8]
LDCM0323	AC6	HCT 116	C147(0.53); C70(0.97); C374(1.18)	LDD0640	[8]
LDCM0324	AC60	HCT 116	C147(0.78); C6(1.01); C70(1.01); C374(1.20)	LDD0641	[8]
LDCM0325	AC61	HCT 116	C147(0.75); C70(0.98); C6(1.22); C374(1.25)	LDD0642	[8]
LDCM0326	AC62	HCT 116	C147(0.80); C6(0.99); C70(1.34); C374(1.45)	LDD0643	[8]
LDCM0327	AC63	HCT 116	C147(0.79); C6(0.98); C70(1.01); C374(1.25)	LDD0644	[8]
LDCM0328	AC64	HCT 116	C6(0.93); C147(0.97); C70(0.98); C374(1.35)	LDD0645	[8]
LDCM0329	AC65	HCT 116	C147(0.91); C6(1.23); C70(1.29); C374(1.64)	LDD0646	[8]
LDCM0330	AC66	HCT 116	C147(0.97); C70(1.11); C6(1.25); C374(1.63)	LDD0647	[8]
LDCM0331	AC67	HCT 116	C147(0.87); C70(0.99); C6(1.21); C374(1.77)	LDD0648	[8]
LDCM0332	AC68	HCT 116	C147(0.74); C6(0.75); C70(0.83); C374(1.15)	LDD0649	[8]
LDCM0333	AC69	HCT 116	C147(0.63); C70(0.77); C6(0.97); C374(1.08)	LDD0650	[8]
LDCM0334	AC7	HCT 116	C147(0.78); C70(1.04); C374(1.13)	LDD0651	[8]
LDCM0335	AC70	HCT 116	C70(0.66); C147(0.67); C6(1.04); C374(1.20)	LDD0652	[8]
LDCM0336	AC71	HCT 116	C147(0.70); C70(0.94); C6(1.00); C374(1.16)	LDD0653	[8]
LDCM0337	AC72	HCT 116	C147(0.65); C70(0.81); C6(1.01); C374(1.05)	LDD0654	[8]
LDCM0338	AC73	HCT 116	C147(0.58); C70(0.83); C6(1.05); C374(1.41)	LDD0655	[8]
LDCM0339	AC74	HCT 116	C147(0.58); C70(0.74); C6(0.86); C374(1.46)	LDD0656	[8]
LDCM0340	AC75	HCT 116	C147(0.68); C70(0.85); C6(1.26); C374(1.68)	LDD0657	[8]
LDCM0341	AC76	HCT 116	C147(0.65); C6(0.96); C70(1.07); C374(1.32)	LDD0658	[8]
LDCM0342	AC77	HCT 116	C147(0.71); C6(1.01); C70(1.09); C374(1.62)	LDD0659	[8]
LDCM0343	AC78	HCT 116	C147(0.76); C70(0.79); C6(0.93); C374(1.13)	LDD0660	[8]
LDCM0344	AC79	HCT 116	C147(0.78); C70(0.92); C6(1.04); C374(1.21)	LDD0661	[8]
LDCM0345	AC8	HCT 116	C70(0.67); C147(0.67); C374(0.97)	LDD0662	[8]
LDCM0346	AC80	HCT 116	C147(0.69); C6(0.86); C70(0.89); C374(1.13)	LDD0663	[8]
LDCM0347	AC81	HCT 116	C70(0.65); C147(0.73); C6(0.89); C374(1.12)	LDD0664	[8]
LDCM0348	AC82	HCT 116	C147(0.56); C70(0.75); C6(0.83); C374(1.70)	LDD0665	[8]
LDCM0349	AC83	HCT 116	C374(1.15)	LDD0666	[8]
LDCM0350	AC84	HCT 116	C374(1.10)	LDD0667	[8]
LDCM0351	AC85	HCT 116	C374(1.14)	LDD0668	[8]
LDCM0352	AC86	HCT 116	C374(1.29)	LDD0669	[8]
LDCM0353	AC87	HCT 116	C374(1.03)	LDD0670	[8]
LDCM0354	AC88	HCT 116	C374(1.45)	LDD0671	[8]
LDCM0355	AC89	HCT 116	C374(1.03)	LDD0672	[8]
LDCM0357	AC90	HCT 116	C374(1.48)	LDD0674	[8]
LDCM0358	AC91	HCT 116	C374(1.52)	LDD0675	[8]
LDCM0359	AC92	HCT 116	C374(1.38)	LDD0676	[8]
LDCM0360	AC93	HCT 116	C374(1.10)	LDD0677	[8]
LDCM0361	AC94	HCT 116	C374(1.05)	LDD0678	[8]
LDCM0362	AC95	HCT 116	C374(1.03)	LDD0679	[8]
LDCM0363	AC96	HCT 116	C374(1.35)	LDD0680	[8]
LDCM0364	AC97	HCT 116	C374(1.12)	LDD0681	[8]
LDCM0365	AC98	HCT 116	C147(0.53); C374(1.46)	LDD0682	[8]
LDCM0366	AC99	HCT 116	C147(0.75); C374(0.98)	LDD0683	[8]
LDCM0520	AKOS000195272	MDA-MB-231	C374(0.90)	LDD2113	[5]
LDCM0248	AKOS034007472	HCT 116	C147(0.83); C374(1.09); C70(1.10)	LDD0565	[8]
LDCM0356	AKOS034007680	HCT 116	C147(0.63); C374(1.16); C70(1.23)	LDD0673	[8]
LDCM0275	AKOS034007705	HCT 116	C147(0.44); C70(0.76); C374(1.29)	LDD0592	[8]
LDCM0156	Aniline	NCI-H1299	11.83	LDD0403	[1]
LDCM0020	ARS-1620	HCC44	C374(0.97)	LDD0078	[8]
LDCM0498	BS-3668	MDA-MB-231	C374(0.34)	LDD2091	[5]
LDCM0108	Chloroacetamide	HeLa	N.A.	LDD0222	[16]
LDCM0632	CL-Sc	Hep-G2	C6(0.77)	LDD2227	[12]
LDCM0367	CL1	HCT 116	C374(0.99); C70(1.39); C147(1.73)	LDD0684	[8]
LDCM0368	CL10	HCT 116	C147(0.79); C70(1.04); C374(1.16)	LDD0685	[8]
LDCM0369	CL100	HCT 116	C147(0.67); C6(0.95); C374(1.04)	LDD0686	[8]
LDCM0370	CL101	HCT 116	C147(0.64); C70(0.97); C374(1.12)	LDD0687	[8]
LDCM0371	CL102	HCT 116	C147(0.83); C70(1.07); C374(1.24)	LDD0688	[8]
LDCM0372	CL103	HCT 116	C147(0.71); C374(0.98); C70(1.03)	LDD0689	[8]
LDCM0373	CL104	HCT 116	C147(0.66); C70(0.99); C374(1.05)	LDD0690	[8]
LDCM0374	CL105	HCT 116	C70(0.98); C374(1.09)	LDD0691	[8]
LDCM0375	CL106	HCT 116	C70(0.64); C374(1.29)	LDD0692	[8]
LDCM0376	CL107	HCT 116	C70(0.88); C374(1.26)	LDD0693	[8]
LDCM0377	CL108	HCT 116	C70(0.69); C374(1.15)	LDD0694	[8]
LDCM0378	CL109	HCT 116	C70(0.86); C374(1.18)	LDD0695	[8]
LDCM0379	CL11	HCT 116	C147(0.84); C70(0.95); C374(1.26)	LDD0696	[8]
LDCM0380	CL110	HCT 116	C70(0.81); C374(1.20)	LDD0697	[8]
LDCM0381	CL111	HCT 116	C70(0.85); C374(1.12)	LDD0698	[8]
LDCM0382	CL112	HCT 116	C374(1.03); C147(1.10)	LDD0699	[8]
LDCM0383	CL113	HCT 116	C147(0.74); C374(1.20)	LDD0700	[8]
LDCM0384	CL114	HCT 116	C147(0.81); C374(1.17)	LDD0701	[8]
LDCM0385	CL115	HCT 116	C147(0.90); C374(1.06)	LDD0702	[8]
LDCM0386	CL116	HCT 116	C147(0.94); C374(1.16)	LDD0703	[8]
LDCM0387	CL117	HCT 116	C147(0.68); C70(0.79); C374(1.33)	LDD0704	[8]
LDCM0388	CL118	HCT 116	C70(0.85); C374(1.01); C147(1.06)	LDD0705	[8]
LDCM0389	CL119	HCT 116	C70(0.80); C374(1.03); C147(1.05)	LDD0706	[8]
LDCM0390	CL12	HCT 116	C147(0.80); C70(1.04); C374(1.38)	LDD0707	[8]
LDCM0391	CL120	HCT 116	C374(0.93); C70(1.02); C147(1.03)	LDD0708	[8]
LDCM0392	CL121	HCT 116	C374(0.97); C147(1.08); C70(1.12)	LDD0709	[8]
LDCM0393	CL122	HCT 116	C147(0.75); C374(0.91); C70(0.96)	LDD0710	[8]
LDCM0394	CL123	HCT 116	C147(0.81); C374(1.04); C70(1.13)	LDD0711	[8]
LDCM0395	CL124	HCT 116	C147(0.77); C70(0.78); C374(1.09)	LDD0712	[8]
LDCM0396	CL125	HCT 116	C374(1.02); C70(1.04); C147(1.05); C6(1.40)	LDD0713	[8]
LDCM0397	CL126	HCT 116	C147(0.95); C374(1.03); C70(1.03); C6(1.07)	LDD0714	[8]
LDCM0398	CL127	HCT 116	C147(0.93); C70(1.15); C374(1.20); C6(1.34)	LDD0715	[8]
LDCM0399	CL128	HCT 116	C147(0.82); C6(1.13); C70(1.16); C374(1.29)	LDD0716	[8]
LDCM0400	CL13	HCT 116	C147(0.76); C70(0.88); C374(1.16)	LDD0717	[8]
LDCM0401	CL14	HCT 116	C374(1.03); C70(1.11); C147(1.29)	LDD0718	[8]
LDCM0402	CL15	HCT 116	C147(0.56); C70(0.98); C374(1.15)	LDD0719	[8]
LDCM0403	CL16	HCT 116	C147(0.83); C374(0.97)	LDD0720	[8]
LDCM0404	CL17	HCT 116	C147(0.58); C374(1.06)	LDD0721	[8]
LDCM0405	CL18	HCT 116	C147(0.53); C374(1.02)	LDD0722	[8]
LDCM0406	CL19	HCT 116	C147(0.54); C374(0.94)	LDD0723	[8]
LDCM0407	CL2	HCT 116	C374(1.03); C70(1.43); C147(1.48)	LDD0724	[8]
LDCM0408	CL20	HCT 116	C147(0.69); C374(1.07)	LDD0725	[8]
LDCM0409	CL21	HCT 116	C147(0.56); C374(1.18)	LDD0726	[8]
LDCM0410	CL22	HCT 116	C147(0.47); C374(1.24)	LDD0727	[8]
LDCM0411	CL23	HCT 116	C147(0.64); C374(1.03)	LDD0728	[8]
LDCM0412	CL24	HCT 116	C147(0.61); C374(1.07)	LDD0729	[8]
LDCM0413	CL25	HCT 116	C147(0.62); C374(1.21)	LDD0730	[8]
LDCM0414	CL26	HCT 116	C147(0.73); C374(1.03)	LDD0731	[8]
LDCM0415	CL27	HCT 116	C147(0.80); C374(1.04)	LDD0732	[8]
LDCM0416	CL28	HCT 116	C147(0.60); C374(1.10)	LDD0733	[8]
LDCM0417	CL29	HCT 116	C147(0.58); C374(1.11)	LDD0734	[8]
LDCM0418	CL3	HCT 116	C147(1.28); C374(1.02); C70(1.10)	LDD0735	[8]
LDCM0419	CL30	HCT 116	C147(0.73); C374(0.94)	LDD0736	[8]
LDCM0420	CL31	HCT 116	C147(0.97); C374(0.98); C6(0.85); C70(0.81)	LDD0737	[8]
LDCM0421	CL32	HCT 116	C147(0.88); C374(0.90); C6(0.69); C70(0.62)	LDD0738	[8]
LDCM0422	CL33	HCT 116	C147(0.85); C374(1.00); C6(0.70); C70(0.75)	LDD0739	[8]
LDCM0423	CL34	HCT 116	C147(0.82); C374(1.11); C6(0.66); C70(1.10)	LDD0740	[8]
LDCM0424	CL35	HCT 116	C147(1.00); C374(1.08); C6(0.91); C70(0.86)	LDD0741	[8]
LDCM0425	CL36	HCT 116	C147(0.79); C374(1.11); C6(0.70); C70(0.85)	LDD0742	[8]
LDCM0426	CL37	HCT 116	C147(0.96); C374(1.19); C6(0.95); C70(1.03)	LDD0743	[8]
LDCM0428	CL39	HCT 116	C147(0.95); C374(1.01); C6(0.88); C70(1.01)	LDD0745	[8]
LDCM0429	CL4	HCT 116	C147(1.34); C374(1.06); C70(1.12)	LDD0746	[8]
LDCM0430	CL40	HCT 116	C147(1.06); C374(0.93); C6(0.95); C70(0.79)	LDD0747	[8]
LDCM0431	CL41	HCT 116	C147(1.00); C374(1.00); C6(0.70); C70(0.97)	LDD0748	[8]
LDCM0432	CL42	HCT 116	C147(0.70); C374(1.15); C6(1.08); C70(0.78)	LDD0749	[8]
LDCM0433	CL43	HCT 116	C147(0.76); C374(1.11); C6(0.87); C70(0.85)	LDD0750	[8]
LDCM0434	CL44	HCT 116	C147(0.68); C374(0.97); C6(0.94); C70(0.88)	LDD0751	[8]
LDCM0435	CL45	HCT 116	C147(0.82); C374(1.01); C6(1.04); C70(0.83)	LDD0752	[8]
LDCM0436	CL46	HCT 116	C374(0.99)	LDD0753	[8]
LDCM0437	CL47	HCT 116	C374(1.09)	LDD0754	[8]
LDCM0438	CL48	HCT 116	C374(1.04)	LDD0755	[8]
LDCM0439	CL49	HCT 116	C374(1.01)	LDD0756	[8]
LDCM0440	CL5	HCT 116	C147(0.91); C374(1.10); C70(0.99)	LDD0757	[8]
LDCM0441	CL50	HCT 116	C374(1.06)	LDD0758	[8]
LDCM0442	CL51	HCT 116	C374(1.11)	LDD0759	[8]
LDCM0443	CL52	HCT 116	C374(1.18)	LDD0760	[8]
LDCM0444	CL53	HCT 116	C374(1.25)	LDD0761	[8]
LDCM0445	CL54	HCT 116	C374(1.08)	LDD0762	[8]
LDCM0446	CL55	HCT 116	C374(1.11)	LDD0763	[8]
LDCM0447	CL56	HCT 116	C374(1.11)	LDD0764	[8]
LDCM0448	CL57	HCT 116	C374(1.02)	LDD0765	[8]
LDCM0449	CL58	HCT 116	C374(1.09)	LDD0766	[8]
LDCM0450	CL59	HCT 116	C374(1.08)	LDD0767	[8]
LDCM0451	CL6	HCT 116	C147(0.66); C374(1.00); C70(0.72)	LDD0768	[8]
LDCM0452	CL60	HCT 116	C374(1.04)	LDD0769	[8]
LDCM0453	CL61	HCT 116	C374(1.04); C70(0.90)	LDD0770	[8]
LDCM0454	CL62	HCT 116	C374(1.11); C70(0.83)	LDD0771	[8]
LDCM0455	CL63	HCT 116	C374(1.13); C70(0.85)	LDD0772	[8]
LDCM0456	CL64	HCT 116	C374(1.17); C70(0.79)	LDD0773	[8]
LDCM0457	CL65	HCT 116	C374(1.10); C70(0.79)	LDD0774	[8]
LDCM0458	CL66	HCT 116	C374(1.27); C70(0.78)	LDD0775	[8]
LDCM0459	CL67	HCT 116	C374(1.20); C70(0.63)	LDD0776	[8]
LDCM0460	CL68	HCT 116	C374(1.16); C70(0.65)	LDD0777	[8]
LDCM0461	CL69	HCT 116	C374(1.07); C70(0.81)	LDD0778	[8]
LDCM0462	CL7	HCT 116	C147(0.85); C374(1.08); C70(0.99)	LDD0779	[8]
LDCM0463	CL70	HCT 116	C374(1.11); C70(0.82)	LDD0780	[8]
LDCM0464	CL71	HCT 116	C374(1.06); C70(0.71)	LDD0781	[8]
LDCM0465	CL72	HCT 116	C374(1.18); C70(0.72)	LDD0782	[8]
LDCM0466	CL73	HCT 116	C374(1.11); C70(1.21)	LDD0783	[8]
LDCM0467	CL74	HCT 116	C374(1.12); C70(0.76)	LDD0784	[8]
LDCM0469	CL76	HCT 116	C374(1.02); C70(1.00)	LDD0786	[8]
LDCM0470	CL77	HCT 116	C374(1.02); C70(1.39)	LDD0787	[8]
LDCM0471	CL78	HCT 116	C374(1.34); C70(0.99)	LDD0788	[8]
LDCM0472	CL79	HCT 116	C374(1.27); C70(1.18)	LDD0789	[8]
LDCM0473	CL8	HCT 116	C147(0.79); C374(1.54); C70(0.89)	LDD0790	[8]
LDCM0474	CL80	HCT 116	C374(1.14); C70(0.99)	LDD0791	[8]
LDCM0475	CL81	HCT 116	C374(1.20); C70(1.19)	LDD0792	[8]
LDCM0476	CL82	HCT 116	C374(1.31); C70(0.96)	LDD0793	[8]
LDCM0477	CL83	HCT 116	C374(1.35); C70(1.17)	LDD0794	[8]
LDCM0478	CL84	HCT 116	C374(1.64); C70(1.08)	LDD0795	[8]
LDCM0479	CL85	HCT 116	C374(1.41); C70(1.20)	LDD0796	[8]
LDCM0480	CL86	HCT 116	C374(1.09); C70(1.12)	LDD0797	[8]
LDCM0481	CL87	HCT 116	C374(1.20); C70(1.09)	LDD0798	[8]
LDCM0482	CL88	HCT 116	C374(1.20); C70(1.11)	LDD0799	[8]
LDCM0483	CL89	HCT 116	C374(1.63); C70(0.93)	LDD0800	[8]
LDCM0484	CL9	HCT 116	C147(0.88); C374(1.30); C70(0.93)	LDD0801	[8]
LDCM0485	CL90	HCT 116	C374(1.15); C70(1.07)	LDD0802	[8]
LDCM0486	CL91	HCT 116	C147(0.88); C374(1.10); C6(1.37)	LDD0803	[8]
LDCM0487	CL92	HCT 116	C147(0.93); C374(1.03); C6(1.16)	LDD0804	[8]
LDCM0488	CL93	HCT 116	C147(0.88); C374(1.11); C6(1.03)	LDD0805	[8]
LDCM0489	CL94	HCT 116	C147(0.72); C374(1.17); C6(0.93)	LDD0806	[8]
LDCM0490	CL95	HCT 116	C147(0.71); C374(1.11); C6(1.84)	LDD0807	[8]
LDCM0491	CL96	HCT 116	C147(0.73); C374(1.15); C6(1.03)	LDD0808	[8]
LDCM0492	CL97	HCT 116	C147(0.81); C374(0.99); C6(1.20)	LDD0809	[8]
LDCM0493	CL98	HCT 116	C147(0.68); C374(1.09); C6(0.94)	LDD0810	[8]
LDCM0494	CL99	HCT 116	C147(0.74); C374(0.89); C6(1.17)	LDD0811	[8]
LDCM0189	Compound 16	HEK-293T	37.74	LDD0492	[21]
LDCM0184	Compound 20	HEK-293T	14.39	LDD0503	[21]
LDCM0191	Compound 21	HEK-293T	5.57	LDD0493	[21]
LDCM0186	Compound 31	HEK-293T	5.73	LDD0506	[21]
LDCM0187	Compound 32	HEK-293T	10.64	LDD0507	[21]
LDCM0190	Compound 34	HEK-293T	15.50	LDD0497	[21]
LDCM0192	Compound 35	HEK-293T	10.05	LDD0491	[21]
LDCM0194	Compound 37	HEK-293T	7.19	LDD0498	[21]
LDCM0197	Compound 40	HEK-293T	11.43	LDD0495	[21]
LDCM0181	Compound 41	HEK-293T	10.10	LDD0502	[21]
LDCM0634	CY-0357	Hep-G2	C374(0.67)	LDD2228	[12]
LDCM0495	E2913	HEK-293T	C6(0.91); C172(0.86); C70(1.15)	LDD1698	[26]
LDCM0213	Electrophilic fragment 2	MDA-MB-231	C374(12.14); C6(0.50)	LDD1702	[5]
LDCM0625	F8	Ramos	C147(0.66); C374(1.28); C6(1.08)	LDD2187	[27]
LDCM0572	Fragment10	Ramos	C147(1.08); C374(9.86); C6(3.59)	LDD2189	[27]
LDCM0573	Fragment11	Ramos	C147(0.19); C374(0.44); C6(1.00)	LDD2190	[27]
LDCM0574	Fragment12	Ramos	C147(1.29); C374(12.50); C6(6.61)	LDD2191	[27]
LDCM0575	Fragment13	Ramos	C147(0.99); C374(1.12); C6(1.62)	LDD2192	[27]
LDCM0576	Fragment14	Ramos	C147(2.24); C374(12.73); C6(7.89)	LDD2193	[27]
LDCM0579	Fragment20	Ramos	C147(1.48); C374(20.00); C6(11.59)	LDD2194	[27]
LDCM0580	Fragment21	Ramos	C147(1.16); C374(1.50); C6(1.17)	LDD2195	[27]
LDCM0582	Fragment23	Ramos	C147(1.70); C374(0.60); C6(1.63)	LDD2196	[27]
LDCM0578	Fragment27	Ramos	C147(1.07); C374(0.69); C6(0.99)	LDD2197	[27]
LDCM0586	Fragment28	Ramos	C147(0.94); C374(0.99); C6(1.07)	LDD2198	[27]
LDCM0588	Fragment30	Ramos	C147(0.98); C374(3.43); C6(1.90)	LDD2199	[27]
LDCM0589	Fragment31	Ramos	C147(1.33); C374(1.87); C6(1.85)	LDD2200	[27]
LDCM0590	Fragment32	Ramos	C147(0.86); C374(12.12); C6(3.54)	LDD2201	[27]
LDCM0468	Fragment33	HCT 116	C374(1.16); C70(0.83)	LDD0785	[8]
LDCM0596	Fragment38	Ramos	C147(1.10); C374(2.40); C6(3.30)	LDD2203	[27]
LDCM0566	Fragment4	Ramos	C147(1.13); C374(16.05); C6(2.77)	LDD2184	[27]
LDCM0427	Fragment51	HCT 116	C147(0.81); C374(1.23); C6(2.25); C70(0.81)	LDD0744	[8]
LDCM0610	Fragment52	Ramos	C147(0.92); C374(2.02); C6(2.92)	LDD2204	[27]
LDCM0614	Fragment56	Ramos	C147(1.12); C374(1.06); C6(1.76)	LDD2205	[27]
LDCM0569	Fragment7	Ramos	C147(1.08); C374(10.37); C6(4.78)	LDD2186	[27]
LDCM0571	Fragment9	Ramos	C147(2.49); C374(20.00); C6(10.62)	LDD2188	[27]
LDCM0015	HNE	MDA-MB-231	C147(0.59)	LDD0346	[27]
LDCM0022	KB02	HEK-293T	C147(0.89); C70(1.07)	LDD1492	[26]
LDCM0023	KB03	Jurkat	C374(69.10); C6(45.19)	LDD0209	[28]
LDCM0024	KB05	COLO792	C87(2.50); C83(1.51)	LDD3310	[29]
LDCM0528	N-(4-bromophenyl)-2-cyano-N-phenylacetamide	MDA-MB-231	C374(0.62)	LDD2121	[5]
LDCM0109	NEM	HeLa	N.A.	LDD0224	[16]
LDCM0500	Nucleophilic fragment 13a	MDA-MB-231	C374(1.11)	LDD2093	[5]
LDCM0506	Nucleophilic fragment 16a	MDA-MB-231	C374(0.77)	LDD2099	[5]
LDCM0508	Nucleophilic fragment 17a	MDA-MB-231	C374(0.79)	LDD2101	[5]
LDCM0512	Nucleophilic fragment 19a	MDA-MB-231	C374(1.19)	LDD2105	[5]
LDCM0514	Nucleophilic fragment 20a	MDA-MB-231	C374(0.79); C147(1.18)	LDD2107	[5]
LDCM0516	Nucleophilic fragment 21a	MDA-MB-231	C374(1.19); C147(0.72)	LDD2109	[5]
LDCM0518	Nucleophilic fragment 22a	MDA-MB-231	C374(0.72)	LDD2111	[5]
LDCM0522	Nucleophilic fragment 24a	MDA-MB-231	C374(0.82)	LDD2115	[5]
LDCM0526	Nucleophilic fragment 26a	MDA-MB-231	C374(2.50)	LDD2119	[5]
LDCM0530	Nucleophilic fragment 28a	MDA-MB-231	C374(0.84)	LDD2123	[5]
LDCM0532	Nucleophilic fragment 29a	MDA-MB-231	C374(0.81); C147(1.14)	LDD2125	[5]
LDCM0534	Nucleophilic fragment 30a	MDA-MB-231	C374(1.20); C147(1.15)	LDD2127	[5]
LDCM0536	Nucleophilic fragment 31	MDA-MB-231	C374(0.91)	LDD2129	[5]
LDCM0540	Nucleophilic fragment 35	MDA-MB-231	C374(0.88)	LDD2133	[5]
LDCM0541	Nucleophilic fragment 36	MDA-MB-231	C374(0.64)	LDD2134	[5]
LDCM0542	Nucleophilic fragment 37	MDA-MB-231	C374(0.99); C147(0.95)	LDD2135	[5]
LDCM0543	Nucleophilic fragment 38	MDA-MB-231	C374(1.10)	LDD2136	[5]
LDCM0544	Nucleophilic fragment 39	MDA-MB-231	C374(1.02); C147(1.17)	LDD2137	[5]
LDCM0211	Nucleophilic fragment 3b	MDA-MB-231	C374(1.09)	LDD1700	[5]
LDCM0546	Nucleophilic fragment 40	MDA-MB-231	C374(0.86)	LDD2140	[5]
LDCM0550	Nucleophilic fragment 5a	MDA-MB-231	C374(2.59)	LDD2144	[5]
LDCM0552	Nucleophilic fragment 6a	MDA-MB-231	C374(0.80); C147(1.10)	LDD2146	[5]
LDCM0554	Nucleophilic fragment 7a	MDA-MB-231	C374(1.02)	LDD2148	[5]
LDCM0627	NUDT7-COV-1	HEK-293T	C6(0.48)	LDD2206	[30]
LDCM0628	OTUB2-COV-1	HEK-293T	C70(0.85); C6(0.79); C374(0.69)	LDD2207	[30]
LDCM0014	Panhematin	K562	3.13	LDD0063	[6]
LDCM0131	RA190	MM1.R	2.06	LDD0300	[7]
LDCM0084	Ro 48-8071	A-549	2.46	LDD0145	[24]
LDCM0110	W12	Hep-G2	C374(9.07)	LDD0237	[17]
LDCM0111	W14	Hep-G2	C374(6.80)	LDD0238	[17]
LDCM0113	W17	Hep-G2	C374(2.07)	LDD0240	[17]

The Interaction Atlas With This Target

The Protein(s) Related To This Target

Enzyme

Click To Hide/Show 3 Protein(s) Interacting with This Target

Protein name	Family	Uniprot ID
Very long chain fatty acid elongase 4 (ELOVL4)	ELO family	Q9GZR5
ADP-ribosylation factor-like protein 13B (ARL13B)	Arf family	Q3SXY8
TLC domain-containing protein 4 (TLCD4)	TLCD4 family	Q96MV1

Transporter and channel

Click To Hide/Show 5 Protein(s) Interacting with This Target

Protein name	Family	Uniprot ID
Hepatic sodium/bile acid cotransporter (SLC10A1)	Bile acid:sodium symporter (BASS) family	Q14973
Gap junction alpha-8 protein (GJA8)	Connexin family	P48165
Aquaporin-6 (AQP6)	MIP/aquaporin (TC 1.A.8) family	Q13520
Pannexin-1 (PANX1)	Pannexin family	Q96RD7
Thioredoxin-related transmembrane protein 2 (TMX2)	.	Q9Y320

GPCR

Click To Hide/Show 1 Protein(s) Interacting with This Target

Protein name				Family	Uniprot ID
Probable G-protein coupled receptor 152 (GPR152)				G-protein coupled receptor 1 family	Q8TDT2

Immunoglobulin

Click To Hide/Show 1 Protein(s) Interacting with This Target

Protein name				Family	Uniprot ID
B-cell antigen receptor complex-associated protein alpha chain (CD79A)				.	P11912

Other

Click To Hide/Show 2 Protein(s) Interacting with This Target

Protein name				Family	Uniprot ID
Protein FAM209A (FAM209A)				FAM209 family	Q5JX71
Protein jagunal homolog 1 (JAGN1)				Jagunal family	Q8N5M9

The Drug(s) Related To This Target

Investigative

Click To Hide/Show 68 Drug(s) Interacting with This Target

Drug Name	Drug Type	External ID
(Z)-3-[2-(9h-fluoren-2-yloxy)Ethylidene]-quinuclidine Hydrochloride 31	Small molecular drug	D07ABI
1-allyl-2-[3-(Isopropylamino)Propoxy]-9h-carbazole	Small molecular drug	D0X4OP
1-allyl-2-[3-(Isopropylamino)Propoxy]-9h-xanthen-9-one	Small molecular drug	D0S4UA
2-[4-(2-thienyl)Phenyl]-4-methylmorpholin-2-ol	Small molecular drug	D0K1QV
3-[1'-{4'-(Benzyloxy)-phenyl}]-quinuclidine-2-ene	Small molecular drug	D01UKV
3-[7'-(Methoxy)-napht-2'-yl]-quinuclidine-2-ene	Small molecular drug	D0NL2L
Bph-652	Small molecular drug	D0PP5M
Bph-830	Small molecular drug	D03DCE
Cp-294838	Small molecular drug	D0G4ZT
E5700	Small molecular drug	D07JLS
Er-119884	Small molecular drug	D0U0NT
J-104118	Small molecular drug	D06VOJ
J-104123	Small molecular drug	D0I3TX
L-731120	Small molecular drug	D02VUM
L-731128	Small molecular drug	D06RCI
L-735021	Small molecular drug	D00CEN
Pmid12238936c3a	Small molecular drug	D07ICD
Pmid12238936c3f	Small molecular drug	D0Q3DY
Pmid17709461c4g	Small molecular drug	D0Z5BQ
Pmid18754614c10	Small molecular drug	D0M1QJ
Pmid18754614c17	Small molecular drug	D0U9GN
Pmid18754614c18	Small molecular drug	D06PMR
Pmid18754614c19	Small molecular drug	D0A7FI
Pmid18754614c4	Small molecular drug	D0D7IQ
Pmid18754614c7	Small molecular drug	D04AAT
Pmid18754614c8	Small molecular drug	D09TKC
Pmid18754614c9	Small molecular drug	D0Q1XK
Pmid19191557c14	Small molecular drug	D00YIS
Pmid19191557c19	Small molecular drug	D09ATQ
Pmid19191557c21	Small molecular drug	D0G9LW
Pmid19191557c3	Small molecular drug	D0AP5M
Pmid19191557c32	Small molecular drug	D00KMC
Pmid19191557c35	Small molecular drug	D0E1BR
Pmid19191557c8	Small molecular drug	D0WG7H
Pmid19456099c13	Small molecular drug	D00QFL
Pmid19456099c15	Small molecular drug	D0B9EV
Pmid20299227c12	Small molecular drug	D09HKR
Pmid20299227c20	Small molecular drug	D0RN8T
Pmid22464687c15a	Small molecular drug	D0E9TE
Pmid7473541c11	Small molecular drug	D0LT7Y
Pmid7473541c19	Small molecular drug	D0K7GL
Pmid7473541c20	Small molecular drug	D0R8NC
Pmid7473541c21	Small molecular drug	D0ZD1B
Pmid7629799c2d	Small molecular drug	D0MM5G
Pmid7629799c2e	Small molecular drug	D0KJ7C
Pmid7629799c6	Small molecular drug	D06AJN
Pmid7650673c4q	Small molecular drug	D0V4FC
Pmid7966163c3f	Small molecular drug	D07KJI
Pmid7966163c4e	Small molecular drug	D06MMN
Pmid7966163c6c	Small molecular drug	D03CUH
Pmid7966163c6d	Small molecular drug	D0ZT0F
Pmid7966163c6g	Small molecular drug	D09IQG
Pmid8496919c7	Small molecular drug	D0T2DP
Pmid8576905c4	Small molecular drug	D04DZS
Pmid8709131c15	Small molecular drug	D0OF1X
Pmid8709131c17	Small molecular drug	D0MA8Q
Pmid8709131c23	Small molecular drug	D0XN1T
Pmid8709131c2a (+)	Small molecular drug	D0L1ND
Pmid8709131c4	Small molecular drug	D0N4BQ
Pmid9216829c5j	Small molecular drug	D05OHM
Pmid9216829c5m	Small molecular drug	D0S4LW
Pmid9871507c14	Small molecular drug	D00OPO
Ym-75440	Small molecular drug	D0M0HE
Zaragozic Acid B	Small molecular drug	D0OI4E
Zaragozic Acid C	Small molecular drug	D04GSN
Zaragozic Acid D	Small molecular drug	D05URH
Zaragozic Acid D2	Small molecular drug	D0SC4X
Tak-475	.	DB05317

Discontinued

Click To Hide/Show 7 Drug(s) Interacting with This Target

Drug Name	Drug Type	External ID
A-87049	Small molecular drug	D04KDA
Bms-187745	Small molecular drug	D0W1MX
Lapaquistat Acetate	Small molecular drug	D02FXU
Sq-32709	Small molecular drug	D0N5HO
Sq-34919	Small molecular drug	D0RU3M
Squalestatin 1	Small molecular drug	D0O1AV
Rpr-101821	.	D08ALQ

References

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3	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.
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10	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
11	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
12	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
13	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
14	Multiplexed CuAAC Suzuki-Miyaura Labeling for Tandem Activity-Based Chemoproteomic Profiling. Anal Chem. 2021 Feb 2;93(4):2610-2618. doi: 10.1021/acs.analchem.0c04726. Epub 2021 Jan 20. Mass spectrometry data entry: PXD022279
15	DFT-Guided Discovery of Ethynyl-Triazolyl-Phosphinates as Modular Electrophiles for Chemoselective Cysteine Bioconjugation and Profiling. Angew Chem Int Ed Engl. 2022 Oct 10;61(41):e202205348. doi: 10.1002/anie.202205348. Epub 2022 Aug 22. Mass spectrometry data entry: PXD033004
16	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.
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27	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
28	Covalent Inhibition by a Natural Product-Inspired Latent Electrophile. J Am Chem Soc. 2023 May 24;145(20):11097-11109. doi: 10.1021/jacs.3c00598. Epub 2023 May 15.
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Details of the Target

Citation

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Correspondence

Prof. Feng Zhu

Prof. Feng Ni