QuartataWeb 1.0

Data source: DrugBank-all; Query type: chemical; # of requested predictions: 20; Secondary interactions: no
Input drug 1: DB00572

No. Group Type Drug ID Drug Name SMILES
⇨ TargetHunter Image

1 Approved;
Vet approved SmallMoleculeDrug DB00572 Atropine
CN1[C@H]2CC[C@@H]1C[C@@H](C2)OC(=O)C(CO)C1=CC=CC=C1

8 known interactions (targets) of input drug (DB00572): Atropine

No.	Gene	UniProt ID	Protein Name	Pathway	PDB
1	GLRA1	P23415	Glycine receptor subunit alpha-1	hsa04080	1MOT; 1VRY; 2M6B; 2M6I; 4X5T
2	CHRNA4	P43681	Neuronal acetylcholine receptor subunit alpha-4	hsa04080; hsa04725; hsa05033	2GVT; 2LLY
3	CHRM3	P20309	Muscarinic acetylcholine receptor M3	hsa04020; hsa04080; hsa04725; hsa04742; hsa04810; hsa04911; hsa04970; hsa04971; hsa04972	2CSA
4	CHRM4	P08173	Muscarinic acetylcholine receptor M4	hsa04080; hsa04725; hsa04810	NA
5	CHRM1	P11229	Muscarinic acetylcholine receptor M1	hsa04020; hsa04024; hsa04080; hsa04151; hsa04725; hsa04810	NA
6	CHRM5	P08912	Muscarinic acetylcholine receptor M5	hsa04020; hsa04080; hsa04725; hsa04810	NA
7	CHRM2	P08172	Muscarinic acetylcholine receptor M2	hsa04020; hsa04024; hsa04080; hsa04151; hsa04725; hsa04810	1LUB; 3UON; 4MQS; 4MQT
8	CHRNB2	P17787	Neuronal acetylcholine receptor subunit beta-2	hsa04080; hsa04725; hsa05033	2GVT; 2K58; 2K59; 2KSR; 2LM2

20 predicted interactions (targets) of input drug (DB00572): Atropine

No.	Gene	UniProt ID	Protein Name	Pathway	PDB	Confidence score
1	CHRNA7	P36544	Neuronal acetylcholine receptor subunit alpha-7	NA	2MAW; 5AFH; 5AFJ; 5AFK; 5AFL; 5AFM; 5AFN	63.6%
2	CHRNA2	Q15822	Neuronal acetylcholine receptor subunit alpha-2	hsa04080	NA	55.1%
3	HTR2C	P28335	5-hydroxytryptamine receptor 2C	hsa04020; hsa04080; hsa04540; hsa04726; hsa04750	NA	53.1%
4	HTR2A	P28223	5-hydroxytryptamine receptor 2A	hsa04020; hsa04080; hsa04540; hsa04726; hsa04750	NA	53.0%
5	CHRNA3	P32297	Neuronal acetylcholine receptor subunit alpha-3	hsa04080; hsa04725	4ZK4	50.1%
6	HTR3A	P46098	5-hydroxytryptamine receptor 3A	hsa04726; hsa04742	NA	49.3%
7	GABRB1	P18505	Gamma-aminobutyric acid receptor subunit beta-1	hsa04080; hsa04723; hsa04726; hsa04727; hsa05032; hsa05033	NA	46.6%
8	GABRE	P78334	Gamma-aminobutyric acid receptor subunit epsilon	hsa04080; hsa04723; hsa04727; hsa05032; hsa05033	NA	44.7%
9	GABRG2	P18507	Gamma-aminobutyric acid receptor subunit gamma-2	hsa04080; hsa04723; hsa04727; hsa05032; hsa05033	NA	44.4%
10	GLRB	P48167	Glycine receptor subunit beta	hsa04080	NA	44.4%
11	HRH1	P35367	Histamine H1 receptor	hsa04020; hsa04080; hsa04750	3RZE	44.1%
12	GABRB2	P47870	Gamma-aminobutyric acid receptor subunit beta-2	hsa04080; hsa04723; hsa04726; hsa04727; hsa05032; hsa05033	NA	43.9%
13	GABRB3	P28472	Gamma-aminobutyric acid receptor subunit beta-3	hsa04080; hsa04723; hsa04726; hsa04727; hsa05032; hsa05033	4COF	43.8%
14	DRD2	P14416	D(2) dopamine receptor	hsa04015; hsa04024; hsa04080; hsa04540; hsa04728; hsa05012; hsa05030; hsa05034	1I15; 5AER	43.6%
15	GRIN3A	Q8TCU5	Glutamate receptor ionotropic, NMDA 3A	hsa04024; hsa04080; hsa04724; hsa05030; hsa05031; hsa05033; hsa05034	NA	43.5%
16	GABRQ	Q9UN88	Gamma-aminobutyric acid receptor subunit theta	hsa04080; hsa04723; hsa04727; hsa05032; hsa05033	NA	43.4%
17	GABRD	O14764	Gamma-aminobutyric acid receptor subunit delta	hsa04080; hsa04723; hsa04727; hsa05032; hsa05033	NA	43.1%
18	DRD1	P21728	D(1A) dopamine receptor	hsa04020; hsa04024; hsa04080; hsa04540; hsa04728; hsa05012; hsa05030; hsa05031; hsa05032; hsa05034	1OZ5	42.9%
19	HTR2B	P41595	5-hydroxytryptamine receptor 2B	hsa04020; hsa04080; hsa04540; hsa04726; hsa04750	4IB4; 4NC3	42.8%
20	GABRP	O00591	Gamma-aminobutyric acid receptor subunit pi	hsa04080; hsa04723; hsa04727; hsa05032; hsa05033	NA	42.4%