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iGMDRD782

Canonical SMILES: CC1=C2C3C4C(C5(CO5)C(O3)(O4)C(OC)OC)(OC2=C6C(=C1)C(=C7C(CC(C(=O)C7=C6O)O)O)OC)O

InChI: InChI=1S/C25H26O12/c1-8-5-9-13(17(29)15-14(18(9)31-2)10(26)6-11(27)16(15)28)19-12(8)20-21-24(30,35-19)23(7-34-23)25(36-20,37-21)22(32-3)33-4/h5,10-11,20-22,26-27,29-30H,6-7H2,1-4H3/t10-,11-,20-,21-,23-,24+,25-/m0/s1

InChI Key: CPBAGBXYUGCFGT-CBEGQXPNSA-N

Standard Name	Pubchem CID	Drug Status	Drug Type
DC-45-A2	73707400	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.
64901	RANBP17	4
27125	AFF4	2
81037	CLPTM1L	3
471	ATIC	3
7837	PXDN	4
8444	DYRK3	3
21	ABCA3	3
6581	SLC22A3	3
6195	RPS6KA1	3
2048	EPHB2	3
114801	TMEM200A	3
79947	DHDDS	4
8929	PHOX2B	3
4168	MCF2	2
150465	TTL	3
57554	LRRC7	6
1969	EPHA2	4
7272	TTK	4
93	ACVR2B	5
3845	KRAS	3
4750	NEK1	7
2100	ESR2	6
55215	FANCI	5
80070	ADAMTS20	1
25778	DSTYK	2
9760	TOX	2
6597	SMARCA4	1
3326	HSP90AB1	3
9869	SETDB1	2
4036	LRP2	3
7764	ZNF217	2
3320	HSP90AA1	3
22853	LMTK2	2
7253	TSHR	5
3841	KPNA5	3
2241	FER	2
55534	MAML3	2
4149	MAX	2
202374	STK32A	5
1813	DRD2	3
1387	CREBBP	3
8106	PABPN1	3
7555	CNBP	1
23225	NUP210	2
10013	HDAC6	5
31	ACACA	3
9048	ARTN	2
5596	MAPK4	3
5533	PPP3CC	2
9411	ARHGAP29	7
3604	TNFRSF9	2
1111	CHEK1	4
2977	GUCY1A2	1
11122	PTPRT	1
23617	TSSK2	2
6722	SRF	3
9024	BRSK2	6
7373	COL14A1	5
10215	OLIG2	3
5465	PPARA	3
4851	NOTCH1	3
5314	PKHD1	6
139378	ADGRG4	3
9578	CDC42BPB	3
4361	MRE11	4
83439	TCF7L1	2
1454	CSNK1E	2
4595	MUTYH	3
23522	KAT6B	2
55728	N4BP2	4
25925	ZNF521	2
440279	UNC13C	6
4610	MYCL	3
84033	OBSCN	3
1880	GPR183	2
9693	RAPGEF2	3
169436	STKLD1	2
1586	CYP17A1	6
6256	RXRA	2
32	ACACB	4
5613	PRKX	2
64083	GOLPH3	2
4005	LMO2	1
200576	PIKFYVE	2
1050	CEBPA	3
51343	FZR1	5
114548	NLRP3	2
9636	ISG15	1
10217	CTDSPL	2
695	BTK	3
83990	BRIP1	1
6928	HNF1B	6
284217	LAMA1	10
4982	TNFRSF11B	2
2045	EPHA7	2
1992	SERPINB1	5
7078	TIMP3	3
83983	TSSK6	3
6663	SOX10	6
55361	PI4K2A	4
7486	WRN	2
23191	CYFIP1	1
1456	CSNK1G3	3
1452	CSNK1A1	2
1973	EIF4A1	3
5591	PRKDC	4
80312	TET1	2
9472	AKAP6	9
157285	PRAG1	3
472	ATM	6
2580	GAK	2
139285	AMER1	5
3418	IDH2	2
53942	CNTN5	3
11344	TWF2	3
6792	CDKL5	2
1123	CHN1	4
1496	CTNNA2	4
7010	TEK	4
2272	FHIT	1
2066	ERBB4	4
7681	MKRN3	1
904	CCNT1	1
51517	NCKIPSD	3
10290	SPEG	2
2201	FBN2	4
1029	CDKN2A	1
5108	PCM1	3
139728	PNCK	3
57523	NYNRIN	3
83694	RPS6KL1	3
2868	GRK4	2
648	BMI1	3
7157	TP53	4
4173	MCM4	2
6714	SRC	3
6794	STK11	4
93210	PGAP3	1
114788	CSMD3	2
1019	CDK4	3
7409	VAV1	2
9967	THRAP3	2
105	ADARB2	2
8833	GMPS	3
8874	ARHGEF7	3
5597	MAPK6	2
1102	RCBTB2	2
55437	STRADB	2
3572	IL6ST	2
57188	ADAMTSL3	2
984	CDK11B	1
3718	JAK3	3
23365	ARHGEF12	3
57578	UNC79	6
8997	KALRN	4
23269	MGA	1
4089	SMAD4	2
7471	WNT1	2
11168	PSIP1	2
10948	STARD3	1
5727	PTCH1	3
51366	UBR5	3
5606	MAP2K3	8
5297	PI4KA	1
1978	EIF4EBP1	3
10926	DBF4	2
30827	CXXC1	4
56997	COQ8A	1
57144	PAK5	2
4214	MAP3K1	2
3239	HOXD13	6
2187	FANCB	3
84823	LMNB2	3
5290	PIK3CA	1
5034	P4HB	2
2318	FLNC	2
10565	ARFGEF1	2
675	BRCA2	2
3458	IFNG	1
1956	EGFR	10
8445	DYRK2	4
640	BLK	1
4318	MMP9	3
3065	HDAC1	3
4609	MYC	3
2624	GATA2	2
8021	NUP214	2
4684	NCAM1	6
5462	POU5F1B	1
29951	PDZRN4	2
6776	STAT5A	3
5663	PSEN1	2
5592	PRKG1	2
5747	PTK2	2
5156	PDGFRA	3
7917	BAG6	1
375056	MIA3	1
91754	NEK9	1
673	BRAF	6
7153	TOP2A	1
1981	EIF4G1	2
84879	MFSD2A	4
5781	PTPN11	2
22976	PAXIP1	2
4863	NPAT	1
780	DDR1	2
5598	MAPK7	4
65268	WNK2	3
6095	RORA	2
29844	TFPT	2
146057	TTBK2	3
5205	ATP8B1	2
11184	MAP4K1	3
5294	PIK3CG	2
4298	MLLT1	2
5979	RET	4
9451	EIF2AK3	2
664	BNIP3	3
8491	MAP4K3	5
1230	CCR1	2
9509	ADAMTS2	7
4791	NFKB2	6
23396	PIP5K1C	3
23049	SMG1	3
23476	BRD4	3
5728	PTEN	2
57521	RPTOR	3
7155	TOP2B	3
667	DST	3
6770	STAR	5
1676	DFFA	5
9344	TAOK2	5
23090	ZNF423	3
7273	TTN	4
8522	GAS7	2
79834	PEAK1	3
995	CDC25C	3
7454	WAS	1
85415	RHPN2	2
203447	NRK	3
9372	ZFYVE9	3
10249	GLYAT	2
8394	PIP5K1A	2
2353	FOS	2
344905	ATP13A5	2
51151	SLC45A2	3
10076	PTPRU	3
7248	TSC1	3
4619	MYH1	4
2932	GSK3B	1
2317	FLNB	3
10111	RAD50	2
100124696	TEC	3
53353	LRP1B	5
55289	ACOXL	2
5609	MAP2K7	3
1281	COL3A1	5
9201	DCLK1	1
2776	GNAQ	2
2194	FASN	3
4628	MYH10	6
598	BCL2L1	2
3579	CXCR2	6
5589	PRKCSH	3
1975	EIF4B	6
6196	RPS6KA2	2
53335	BCL11A	3
79837	PIP4K2C	1
23301	EHBP1	5
4772	NFATC1	2
51562	MBIP	3
330	BIRC3	3
3656	IRAK2	1
84072	HORMAD1	2
7046	TGFBR1	2
51167	CYB5R4	2
9212	AURKB	3
2903	GRIN2A	2
4217	MAP3K5	3
1026	CDKN1A	2
63923	TNN	3
2065	ERBB3	3
3691	ITGB4	5
7403	KDM6A	4
2534	FYN	2
7508	XPC	2
197259	MLKL	2
3716	JAK1	3
3480	IGF1R	3
51135	IRAK4	2
142	PARP1	6
2261	FGFR3	1
23072	HECW1	3
139604	MAGEB16	2
5567	PRKACB	2
4040	LRP6	3
55422	ZNF331	5
1013	CDH15	2
3092	HIP1	2
1612	DAPK1	2
63893	UBE2O	5
1840	DTX1	3
4591	TRIM37	2
10891	PPARGC1A	3
5288	PIK3C2G	3
2280	FKBP1A	1
4629	MYH11	3
30811	HUNK	4
81788	NUAK2	3
6868	ADAM17	3
2178	FANCE	1
1499	CTNNB1	2
2444	FRK	2
4916	NTRK3	3
1795	DOCK3	2
11035	RIPK3	3
2904	GRIN2B	2
5624	PROC	2
5970	RELA	2

Gene in drug-gene network: Network Plot

Models in DC-45-A2

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DATATYPES

CLASSFICATION

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