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iGMDRD634

Canonical SMILES: C1=CC=C(C=C1)N(C2=CC=CC=C2)C3=CC=C(C=C3)C=NNC(=O)CCCCCCC(=O)NO

InChI: InChI=1S/C27H30N4O3/c32-26(15-9-1-2-10-16-27(33)30-34)29-28-21-22-17-19-25(20-18-22)31(23-11-5-3-6-12-23)24-13-7-4-8-14-24/h3-8,11-14,17-21,34H,1-2,9-10,15-16H2,(H,29,32)(H,30,33)/b28-21+

InChI Key: KXWWYFKVBFUVIZ-SGWCAAJKSA-N

Standard Name	Pubchem CID	Drug Status	Drug Type
SCHEMBL2608041	44601500	Alone	Small Molecule

Drug-model tissue-cancer distribution: Bubble Plot

Drug-gene pathway enrichments

Drug-gene GO enrichments

Drug-Gene: Aster Plot

Gene ID	Gene Name	Model Num.
3696	ITGB8	4
6664	SOX11	6
81037	CLPTM1L	7
5027	P2RX7	3
10903	MTMR11	2
23085	ERC1	6
9261	MAPKAPK2	3
132	ADK	11
6774	STAT3	3
7750	ZMYM2	2
11183	MAP4K5	2
2986	GUCY2F	3
2048	EPHB2	3
114801	TMEM200A	2
4627	MYH9	5
10806	SDCCAG8	5
2956	MSH6	2
2200	FBN1	4
150465	TTL	6
1520	CTSS	4
9149	DYRK1B	2
93	ACVR2B	1
3845	KRAS	3
2335	FN1	3
84700	MYO18B	2
5593	PRKG2	2
6938	TCF12	3
9475	ROCK2	2
6597	SMARCA4	2
81035	COLEC12	3
9869	SETDB1	7
353345	GPR141	3
7444	VRK2	2
5754	PTK7	2
51684	SUFU	3
23235	SIK2	4
4170	MCL1	1
6732	SRPK1	2
8749	ADAM18	2
2241	FER	2
140469	MYO3B	5
2249	FGF4	2
51199	NIN	4
577	ADGRB3	1
114783	LMTK3	1
1387	CREBBP	1
10454	TAB1	3
5467	PPARD	2
23225	NUP210	3
56164	STK31	4
4881	NPR1	6
5579	PRKCB	3
11200	CHEK2	3
31	ACACA	3
9070	ASH2L	3
9411	ARHGAP29	2
29998	BICRA	2
8295	TRRAP	5
2977	GUCY1A2	2
11122	PTPRT	1
23617	TSSK2	4
5899	RALB	2
6722	SRF	3
5465	PPARA	2
2120	ETV6	1
5314	PKHD1	2
5605	MAP2K2	6
139378	ADGRG4	2
8784	TNFRSF18	3
83439	TCF7L1	4
1021	CDK6	3
1454	CSNK1E	3
23522	KAT6B	2
10818	FRS2	5
4610	MYCL	4
4301	AFDN	3
55819	RNF130	1
84033	OBSCN	2
5900	RALGDS	2
51776	MAP3K20	3
152137	CCDC50	6
1880	GPR183	2
3621	ING1	4
9693	RAPGEF2	1
4478	MSN	1
222484	LNX2	2
1586	CYP17A1	2
6256	RXRA	4
32	ACACB	2
3556	IL1RAP	4
329	BIRC2	2
7416	VDAC1	3
4005	LMO2	12
3645	INSRR	6
1437	CSF2	3
8313	AXIN2	7
6733	SRPK2	3
1050	CEBPA	6
2260	FGFR1	1
5330	PLCB2	3
10188	TNK2	2
11169	WDHD1	1
29904	EEF2K	1
597	BCL2A1	3
3688	ITGB1	3
1984	EIF5A	6
7088	TLE1	2
4982	TNFRSF11B	2
1277	COL1A1	2
7078	TIMP3	3
171019	ADAMTS19	3
7428	VHL	2
22858	ICK	3
94103	ORMDL3	1
65266	WNK4	2
6850	SYK	4
287015	TRIM42	3
57476	GRAMD1B	11
7486	WRN	5
5127	CDK16	2
6416	MAP2K4	9
1452	CSNK1A1	3
8714	ABCC3	3
57510	XPO5	3
1909	EDNRA	3
50488	MINK1	5
5568	PRKACG	3
54437	SEMA5B	3
5229	PGGT1B	2
728642	CDK11A	3
8148	TAF15	6
575	ADGRB1	2
53942	CNTN5	9
84433	CARD11	5
4804	NGFR	3
4058	LTK	3
6792	CDKL5	2
54986	ULK4	2
7010	TEK	3
7533	YWHAH	1
5450	POU2AF1	4
898	CCNE1	2
2272	FHIT	5
28951	TRIB2	4
56648	EIF5A2	3
10290	SPEG	6
9319	TRIP13	3
2201	FBN2	5
9794	MAML1	3
5129	CDK18	2
8576	STK16	1
28514	DLL1	1
6092	ROBO2	6
4088	SMAD3	3
4173	MCM4	5
79058	ASPSCR1	3
57194	ATP10A	3
960	CD44	4
8218	CLTCL1	3
5910	RAP1GDS1	1
10114	HIPK3	11
2329	FMO4	2
147746	HIPK4	3
114788	CSMD3	1
5585	PKN1	3
9639	ARHGEF10	2
7249	TSC2	3
7409	VAV1	2
65243	ZFP69B	7
64386	MMP25	3
1555	CYP2B6	1
5600	MAPK11	1
369	ARAF	5
3572	IL6ST	4
57188	ADAMTSL3	2
57591	MRTFA	6
676	BRDT	2
5650	KLK7	3
23365	ARHGEF12	2
8831	SYNGAP1	2
84181	CHD6	2
4026	LPP	1
8997	KALRN	2
3643	INSR	1
51284	TLR7	2
8288	EPX	3
6654	SOS1	3
1616	DAXX	2
2668	GDNF	5
10948	STARD3	3
1848	DUSP6	5
4139	MARK1	3
256536	TCERG1L	3
285220	EPHA6	4
546	ATRX	4
3426	CFI	3
5606	MAP2K3	2
10926	DBF4	3
4958	OMD	3
8216	LZTR1	3
286133	SCARA5	3
1198	CLK3	5
5290	PIK3CA	1
3562	IL3	2
92335	STRADA	3
1514	CTSL	3
4145	MATK	3
1687	GSDME	3
8202	NCOA3	1
26524	LATS2	5
7043	TGFB3	1
10155	TRIM28	3
7075	TIE1	3
8445	DYRK2	2
640	BLK	1
91	ACVR1B	1
5155	PDGFB	1
1459	CSNK2A2	4
8795	TNFRSF10B	2
26278	SACS	5
6776	STAT5A	8
833	CARS	2
1594	CYP27B1	1
3635	INPP5D	3
1653	DDX1	5
375056	MIA3	1
10971	YWHAQ	3
1544	CYP1A2	6
10000	AKT3	5
7153	TOP2A	1
84879	MFSD2A	6
120892	LRRK2	12
65268	WNK2	3
8986	RPS6KA4	3
6095	RORA	3
146057	TTBK2	6
5205	ATP8B1	2
460	ASTN1	5
9064	MAP3K6	2
4298	MLLT1	7
9321	TRIP11	2
664	BNIP3	3
4853	NOTCH2	5
9509	ADAMTS2	7
266747	RGL4	1
23049	SMG1	2
8312	AXIN1	3
57521	RPTOR	4
208	AKT2	1
1487	CTBP1	3
1869	E2F1	3
22883	CLSTN1	5
667	DST	2
5305	PIP4K2A	2
2897	GRIK1	5
140803	TRPM6	3
4317	MMP8	2
6146	RPL22	5
6009	RHEB	3
1676	DFFA	3
9344	TAOK2	5
1445	CSK	3
1018	CDK3	3
79834	PEAK1	8
5582	PRKCG	3
7036	TFR2	5
6787	NEK4	3
54904	NSD3	2
53904	MYO3A	1
387	RHOA	3
79012	CAMKV	2
3161	HMMR	2
9372	ZFYVE9	8
54861	SNRK	4
55561	CDC42BPG	2
1027	CDKN1B	2
84930	MASTL	4
5532	PPP3CB	2
8394	PIP5K1A	4
2353	FOS	5
23305	ACSL6	3
1493	CTLA4	3
7248	TSC1	3
4619	MYH1	2
2869	GRK5	2
2317	FLNB	3
9021	SOCS3	3
10111	RAD50	2
100124696	TEC	3
9223	MAGI1	2
1789	DNMT3B	2
5609	MAP2K7	3
9659	PDE4DIP	3
9201	DCLK1	1
63976	PRDM16	2
7293	TNFRSF4	2
2194	FASN	3
598	BCL2L1	2
2213	FCGR2B	1
3579	CXCR2	3
5587	PRKD1	1
5583	PRKCH	2
5170	PDPK1	4
5681	PSKH1	2
2157	F8	2
53335	BCL11A	3
5506	PPP1R3A	2
8428	STK24	4
80216	ALPK1	2
84072	HORMAD1	9
11076	TPPP	3
7913	DEK	1
5087	PBX1	2
6653	SORL1	3
2903	GRIN2A	5
7124	TNF	2
63923	TNN	2
3691	ITGB4	2
7403	KDM6A	2
54790	TET2	3
7508	XPC	4
5586	PKN2	2
7040	TGFB1	2
9878	TOX4	2
3716	JAK1	3
51135	IRAK4	1
142	PARP1	2
374	AREG	3
57697	FANCM	2
5260	PHKG1	1
55791	LRIF1	2
1994	ELAVL1	2
4613	MYCN	4
494551	WEE2	3
2044	EPHA5	1
2280	FKBP1A	3
4629	MYH11	2
3265	HRAS	3
4193	MDM2	2
6868	ADAM17	1
23112	TNRC6B	3
2178	FANCE	2
27255	CNTN6	3
1499	CTNNB1	6
2444	FRK	7
56155	TEX14	3
2892	GRIA3	2
4916	NTRK3	6
11035	RIPK3	3
2904	GRIN2B	2

Gene in drug-gene network: Network Plot

Models in SCHEMBL2608041

SITE

DATATYPES

CLASSFICATION

Disclaimer: iGMDR is intended for research purposes only. Its information cannot be used for emergencies or medical or professional advice.