Results

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Compound	Target ID	Protein name	Protein family	Gene symbol	Gene ID	Organism	Score	Rank
[1] Untitled Original SMILES: CC[C@H](C)[C@@H]1[C@H](C=C[C@@]2(O1)C[C@@H]3C[C@H](O2)C/C=C([C@H]([C@H](/C=C/C=C4CO[C@H]5[C@@]\4([C@@H](C=C([C@H]5O)C)C(O3)=O)O)C)O[C@H]6C[C@@H]([C@H]([C@@H](O6)C)O[C@H]7C[C@@H]([C@H]([C@@H](O7)C)O)OC)OC)\C)C Prepared SMILES: CO[C@H]1C[C@H](O[C@H]2[C@@H](C)/C=C/C=C/3\CO[C@H]4[C@]3(O)[C@@H](C=C([C@H]4O)C)C(=O)O[C@H]3C[C@@H](C/C=C/2\C)O[C@]2(C3)C=C[C@@H]([C@H](O2)[C@H](CC)C)C)O[C@H]([C@@H]1O[C@H]1C[C@H](OC)[C@H]([C@@H](O1)C)O)C	Q15722	Leukotriene B4 receptor 1 (LTB4-R 1) (LTB4-R1) (Chemoattractant receptor-like 1) ...	G-protein coupled receptor 1 family	LTB4R	1241;	Homo sapiens (Human)	3.1005	1
	P37268	Squalene synthase (SQS) (SS) (EC 2.5.1.21) (FPP:FPP farnesyltransferase) (Farnesyl-diphosphate farnesyltransferase)	Phytoene/squalene synthase family	FDFT1	2222;	Homo sapiens (Human)	2.95573	2
	P08172	Muscarinic acetylcholine receptor M2	G-protein coupled receptor 1 family, Muscarinic acetylcholine receptor subfamily, CHRM2 ...	CHRM2	1129;	Homo sapiens (Human)	2.83132	3
	P21554	Cannabinoid receptor 1 (CB-R) (CB1) (CANN6)	G-protein coupled receptor 1 family	CNR1	1268;	Homo sapiens (Human)	2.75079	4
	Q16236	Nuclear factor erythroid 2-related factor 2 (NF-E2-related factor 2) (NFE2-related ...	BZIP family, CNC subfamily	NFE2L2	4780;	Homo sapiens (Human)	2.7082	5
	P41145	Kappa-type opioid receptor (K-OR-1) (KOR-1)	G-protein coupled receptor 1 family	OPRK1	4986;	Homo sapiens (Human)	2.69355	6
	P34972	Cannabinoid receptor 2 (CB-2) (CB2) (hCB2) (CX5)	G-protein coupled receptor 1 family	CNR2	1269;	Homo sapiens (Human)	2.38959	7
	P11511	Aromatase (EC 1.14.14.14) (CYPXIX) (Cytochrome P-450AROM) (Cytochrome P450 19A1) (Estrogen ...	Cytochrome P450 family	CYP19A1	1588;	Homo sapiens (Human)	2.35364	8
	P20309	Muscarinic acetylcholine receptor M3	G-protein coupled receptor 1 family, Muscarinic acetylcholine receptor subfamily, CHRM3 ...	CHRM3	1131;	Homo sapiens (Human)	2.29723	9
	P22303	Acetylcholinesterase (AChE) (EC 3.1.1.7)	Type-B carboxylesterase/lipase family	ACHE	43;	Homo sapiens (Human)	2.28788	10
	P06276	Cholinesterase (EC 3.1.1.8) (Acylcholine acylhydrolase) (Butyrylcholine esterase) (Choline esterase II) ...	Type-B carboxylesterase/lipase family	BCHE	590;	Homo sapiens (Human)	2.28168	11
	P04035	3-hydroxy-3-methylglutaryl-coenzyme A reductase (HMG-CoA reductase) (EC 1.1.1.34)	HMG-CoA reductase family	HMGCR	3156;	Homo sapiens (Human)	2.18899	12
	Q92731	Estrogen receptor beta (ER-beta) (Nuclear receptor subfamily 3 group A ...	Nuclear hormone receptor family, NR3 subfamily	ESR2	2100;	Homo sapiens (Human)	2.18801	13
	P04150	Glucocorticoid receptor (GR) (Nuclear receptor subfamily 3 group C member ...	Nuclear hormone receptor family, NR3 subfamily	NR3C1	2908;	Homo sapiens (Human)	2.17462	14
	P25101	Endothelin-1 receptor (Endothelin receptor type A) (ET-A) (ETA-R) (hET-AR)	G-protein coupled receptor 1 family, Endothelin receptor subfamily, EDNRA sub-subfamily	EDNRA	1909;	Homo sapiens (Human)	2.13238	15
	P08173	Muscarinic acetylcholine receptor M4	G-protein coupled receptor 1 family, Muscarinic acetylcholine receptor subfamily, CHRM4 ...	CHRM4	1132;	Homo sapiens (Human)	2.09805	16
	P11229	Muscarinic acetylcholine receptor M1	G-protein coupled receptor 1 family, Muscarinic acetylcholine receptor subfamily, CHRM1 ...	CHRM1	1128;	Homo sapiens (Human)	1.95256	17
	P00918	Carbonic anhydrase 2 (EC 4.2.1.1) (Carbonate dehydratase II) (Carbonic anhydrase ...	Alpha-carbonic anhydrase family	CA2	760;	Homo sapiens (Human)	1.95043	18
	P25090	N-formyl peptide receptor 2 (FMLP-related receptor I) (FMLP-R-I) (Formyl peptide ...	G-protein coupled receptor 1 family	FPR2	2358;	Homo sapiens (Human)	1.93258	19
	P49286	Melatonin receptor type 1B (Mel-1B-R) (Mel1b receptor)	G-protein coupled receptor 1 family	MTNR1B	4544;	Homo sapiens (Human)	1.89871	20
	O43570	Carbonic anhydrase 12 (EC 4.2.1.1) (Carbonate dehydratase XII) (Carbonic anhydrase ...	Alpha-carbonic anhydrase family	CA12	771;	Homo sapiens (Human)	1.8961	21
	P35408	Prostaglandin E2 receptor EP4 subtype (PGE receptor EP4 subtype) (PGE2 ...	G-protein coupled receptor 1 family	PTGER4	5734;	Homo sapiens (Human)	1.85773	22
	P41146	Nociceptin receptor (Kappa-type 3 opioid receptor) (KOR-3) (Orphanin FQ receptor)	G-protein coupled receptor 1 family	OPRL1	4987;	Homo sapiens (Human)	1.83275	23
	P35228	Nitric oxide synthase, inducible (EC 1.14.13.39) (Hepatocyte NOS) (HEP-NOS) (Inducible ...	NOS family	NOS2	4843;	Homo sapiens (Human)	1.77212	24
	P43235	Cathepsin K (EC 3.4.22.38) (Cathepsin O) (Cathepsin O2) (Cathepsin X)	Peptidase C1 family	CTSK	1513;	Homo sapiens (Human)	1.77111	25
	P35372	Mu-type opioid receptor (M-OR-1) (MOR-1) (Mu opiate receptor) (Mu opioid ...	G-protein coupled receptor 1 family	OPRM1	4988;	Homo sapiens (Human)	1.76657	26
	P31639	Sodium/glucose cotransporter 2 (Na(+)/glucose cotransporter 2) (Low affinity sodium-glucose cotransporter) ...	Sodium:solute symporter (SSF) (TC 2.A.21) family	SLC5A2	6524;	Homo sapiens (Human)	1.75542	27
	P28223	5-hydroxytryptamine receptor 2A (5-HT-2) (5-HT-2A) (Serotonin receptor 2A)	G-protein coupled receptor 1 family	HTR2A	3356;	Homo sapiens (Human)	1.73864	28
	Q8NER1	Transient receptor potential cation channel subfamily V member 1 (TrpV1) ...	Transient receptor (TC 1.A.4) family, TrpV subfamily, TRPV1 sub-subfamily	TRPV1	7442;	Homo sapiens (Human)	1.7211	29
	P12821	Angiotensin-converting enzyme (ACE) (EC 3.2.1.-) (EC 3.4.15.1) (Dipeptidyl carboxypeptidase I) ...	Peptidase M2 family	ACE	1636;	Homo sapiens (Human)	1.71005	30
	P27487	Dipeptidyl peptidase 4 (EC 3.4.14.5) (ADABP) (Adenosine deaminase complexing protein ...	Peptidase S9B family, DPPIV subfamily	DPP4	1803;	Homo sapiens (Human)	1.67107	31
	Q16665	Hypoxia-inducible factor 1-alpha (HIF-1-alpha) (HIF1-alpha) (ARNT-interacting protein) (Basic-helix-loop-helix-PAS protein MOP1) ...		HIF1A	3091;	Homo sapiens (Human)	1.66045	32
	Q9ULY5	C-type lectin domain family 4 member E (C-type lectin superfamily ...		CLEC4E	26253;	Homo sapiens (Human)	1.65042	33
	Q04609	Glutamate carboxypeptidase 2 (EC 3.4.17.21) (Cell growth-inhibiting gene 27 protein) ...	Peptidase M28 family, M28B subfamily	FOLH1	2346;	Homo sapiens (Human)	1.62477	34
	P08908	5-hydroxytryptamine receptor 1A (5-HT-1A) (5-HT1A) (G-21) (Serotonin receptor 1A)	G-protein coupled receptor 1 family, 5-hydroxytryptamine receptor subfamily, HTR1A sub-subfamily	HTR1A	3350;	Homo sapiens (Human)	1.60115	35
	P43115	Prostaglandin E2 receptor EP3 subtype (PGE receptor EP3 subtype) (PGE2 ...	G-protein coupled receptor 1 family	PTGER3	5733;	Homo sapiens (Human)	1.58458	36
	Q13547	Histone deacetylase 1 (HD1) (EC 3.5.1.98)	Histone deacetylase family, HD type 1 subfamily	HDAC1	3065;	Homo sapiens (Human)	1.57647	37
	P08912	Muscarinic acetylcholine receptor M5	G-protein coupled receptor 1 family, Muscarinic acetylcholine receptor subfamily, CHRM5 ...	CHRM5	1133;	Homo sapiens (Human)	1.57367	38
	P48039	Melatonin receptor type 1A (Mel-1A-R) (Mel1a receptor)	G-protein coupled receptor 1 family	MTNR1A	4543;	Homo sapiens (Human)	1.55201	39
	P17252	Protein kinase C alpha type (PKC-A) (PKC-alpha) (EC 2.7.11.13)	Protein kinase superfamily, AGC Ser/Thr protein kinase family, PKC subfamily	PRKCA	5578;	Homo sapiens (Human)	1.55084	40
	P35367	Histamine H1 receptor (H1R) (HH1R)	G-protein coupled receptor 1 family	HRH1	3269;	Homo sapiens (Human)	1.5508	41
	O43193	Motilin receptor (G-protein coupled receptor 38)	G-protein coupled receptor 1 family	MLNR	2862;	Homo sapiens (Human)	1.54921	42
	Q13639	5-hydroxytryptamine receptor 4 (5-HT-4) (5-HT4) (Serotonin receptor 4)	G-protein coupled receptor 1 family	HTR4	3360;	Homo sapiens (Human)	1.54332	43
	P07550	Beta-2 adrenergic receptor (Beta-2 adrenoreceptor) (Beta-2 adrenoceptor)	G-protein coupled receptor 1 family, Adrenergic receptor subfamily, ADRB2 sub-subfamily	ADRB2	154;	Homo sapiens (Human)	1.53324	44
	P08235	Mineralocorticoid receptor (MR) (Nuclear receptor subfamily 3 group C member ...	Nuclear hormone receptor family, NR3 subfamily	NR3C2	4306;	Homo sapiens (Human)	1.52697	45
	P10275	Androgen receptor (Dihydrotestosterone receptor) (Nuclear receptor subfamily 3 group C ...	Nuclear hormone receptor family, NR3 subfamily	AR	367;	Homo sapiens (Human)	1.51631	46
	P12872	Promotilin [Cleaved into: Motilin; Motilin-associated peptide (MAP)]	Motilin family	MLN	4295;	Homo sapiens (Human)	1.51516	47
	Q9Y5N1	Histamine H3 receptor (H3R) (HH3R) (G-protein coupled receptor 97)	G-protein coupled receptor 1 family	HRH3	11255;	Homo sapiens (Human)	1.43849	48
	P00797	Renin (EC 3.4.23.15) (Angiotensinogenase)	Peptidase A1 family	REN	5972;	Homo sapiens (Human)	1.41554	49
	Q16539	Mitogen-activated protein kinase 14 (MAP kinase 14) (MAPK 14) (EC ...	Protein kinase superfamily, CMGC Ser/Thr protein kinase family, MAP kinase ...	MAPK14	1432;	Homo sapiens (Human)	1.37535	50

Job Information

Job ID	Submitted date	Prediction type	Method	Network	Molecular fingerprint	Other parameter(s)	Score matrix
17894	2025-09-27 18:26:35	Target proteins	Weighted Substructure-Drug-Target Network-Based Inference (wSDTNBI)	Global drug-target interaction (DTI) network (version 2020)	PubChem Download	α = 0.4, β = 0.2, γ = -0.5, k = 2, Top 50	Download

Results

[1] Untitled

Job Information