Ligand name: 7-[4-[4-[2,3-bis(chloranyl)phenyl]piperazin-1-yl]butoxy]-3,4-dihydro-1H-quinolin-2-one
PDB ligand accession: 9SC
DrugBank: DB01238
PubChem: 60795
ChEMBL: CHEMBL1112
InChI Key: CEUORZQYGODEFX-UHFFFAOYSA-N
SMILES: c1cc(c(c(c1)Cl)Cl)N2CCN(CC2)CCCCOc3ccc4c(c3)NC(=O)CC4

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organoheterocyclic compounds
    • Class: Diazinanes
      • Subclass: Piperazines

List of proteins that are targets for 9SC

#	DrugDomain Data	UniProt Accession	Protein name	Drug Action	Affinity data
1	P28335_9SC	P28335	5-hydroxytryptamine receptor 2C	antagonist	Ki(nM) = 18.0 IC50(nM) = 1380.0
2	P14416_9SC	P14416	D(2) dopamine receptor	antagonist	Ki(nM) = 0.2 IC50(nM) = 7.6 EC50(nM) = 1.0
3	P41595_9SC	P41595	5-hydroxytryptamine receptor 2B	inverse agonist	Ki(nM) = 0.36
4	P18825_9SC	P18825	Alpha-2C adrenergic receptor	antagonist	Ki(nM) = 37.0
5	P11229_9SC	P11229	Muscarinic acetylcholine receptor	ligand	Ki(nM) = 6780.0
6	P02768_9SC	P02768	Albumin	n/a
7	P28221_9SC	P28221	5-hydroxytryptamine receptor 1D	antagonist	Ki(nM) = 68.0
8	P35367_9SC	P35367	Histamine H1 receptor	antagonist	Ki(nM) = 25.0 IC50(nM) = 420.0
9	P34969_9SC	P34969	5-hydroxytryptamine receptor 7	antagonist	Ki(nM) = 9.6
10	P18089_9SC	P18089	Alpha-2B adrenergic receptor	antagonist	Ki(nM) = 102.0
11	P07550_9SC	P07550	Beta-2 adrenergic receptor	ligand	Ki(nM) = 163.0
12	P35462_9SC	P35462	D(3) dopamine receptor	antagonist	Ki(nM) = 0.8 EC50(nM) = 19.0
13	P41143_9SC	P41143	Delta-type opioid receptor	ligand	Ki(nM) = 10000.0
14	P08912_9SC	P08912	Muscarinic acetylcholine receptor	ligand	Ki(nM) = 2330.0
15	P31645_9SC	P31645	Sodium-dependent serotonin transporter	modulator	Ki(nM) = 32.0
16	P35368_9SC	P35368	Alpha-1B adrenergic receptor	antagonist	Ki(nM) = 34.8
17	P25021_9SC	P25021	Histamine H2 receptor	ligand	Ki(nM) = 10000.0
18	P08173_9SC	P08173	Muscarinic acetylcholine receptor	ligand	Ki(nM) = 1520.0
19	P35348_9SC	P35348	Alpha-1A adrenergic receptor	antagonist	Ki(nM) = 8.9 IC50(nM) = 170.0
20	P0ABE7_9SC	P0ABE7	Soluble cytochrome b562	n/a
21	P20309_9SC	P20309	Muscarinic acetylcholine receptor	ligand	Ki(nM) = 4677.0 IC50(nM) = 100000.0
22	P21918_9SC	P21918	D(1B) dopamine receptor	antagonist	Ki(nM) = 1051.0
23	P28222_9SC	P28222	5-hydroxytryptamine receptor 1B	antagonist	Ki(nM) = 830.0
24	Q01959_9SC	Q01959	Sodium-dependent dopamine transporter	modulator	Ki(nM) = 3220.0
25	P28223_9SC	P28223	5-hydroxytryptamine receptor 2A	antagonist	Ki(nM) = 0.8 IC50(nM) = 1100.0
26	P28566_9SC	P28566	5-hydroxytryptamine receptor 1E	antagonist	Ki(nM) = 8000.0
27	P08172_9SC	P08172	Muscarinic acetylcholine receptor	ligand	Ki(nM) = 3510.0
28	Q9H3N8_9SC	Q9H3N8	Histamine H4 receptor	ligand	Ki(nM) = 10000.0
29	Q9Y5N1_9SC	Q9Y5N1	Histamine H3 receptor	ligand	Ki(nM) = 2361.0
30	P21728_9SC	P21728	D(1A) dopamine receptor	antagonist	Ki(nM) = 310.0
31	P46098_9SC	P46098	5-hydroxytryptamine receptor 3A	antagonist
32	P50406_9SC	P50406	5-hydroxytryptamine receptor 6	antagonist	Ki(nM) = 89.0
33	P41145_9SC	P41145	Kappa-type opioid receptor	ligand	Ki(nM) = 10000.0
34	P08588_9SC	P08588	Beta-1 adrenergic receptor	ligand	Ki(nM) = 141.0
35	P47898_9SC	P47898	5-hydroxytryptamine receptor 5A	ligand	Ki(nM) = 1240.0
36	P08913_9SC	P08913	Alpha-2A adrenergic receptor	antagonist	Ki(nM) = 74.0
37	P35372_9SC	P35372	Mu-type opioid receptor	ligand	Ki(nM) = 10000.0
38	P21917_9SC	P21917	D(4) dopamine receptor	antagonist	Ki(nM) = 44.0
39	P08908_9SC	P08908	5-hydroxytryptamine receptor 1A	partial agonist	Ki(nM) = 1.7 EC50(nM) = 24.0