Ligand name: Amitriptyline
PDB ligand accession: TP0
DrugBank: DB00321
PubChem: 2160
ChEMBL: CHEMBL629
InChI Key: KRMDCWKBEZIMAB-UHFFFAOYSA-N
SMILES: CN(C)CCC=C1c2ccccc2CCc3c1cccc3

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Benzenoids
    • Class: Dibenzocycloheptenes
      • Subclass: None

List of proteins that are targets for DB00321

#	DrugDomain Data	UniProt Accession	Protein name	Drug Action	Affinity data
1	P35348_TP0	P35348	Alpha-1A adrenergic receptor	antagonist	Ki(nM) = 4.4
2	P04629_TP0	P04629	High affinity nerve	agonist	IC50(nM) = 60000.0 Kd(nM) = 1800000.0 EC50(nM) = 86000.0
3	P08908_TP0	P08908	5-hydroxytryptamine receptor 1A	inhibitor	Ki(nM) = 450.0
4	P34969_TP0	P34969	5-hydroxytryptamine receptor 7	antagonist
5	P25100_TP0	P25100	Alpha-1D adrenergic receptor	antagonist
6	O43525_TP0	O43525	Potassium voltage-gated channel	inhibitor
7	P35372_TP0	P35372	Mu-type opioid receptor	binder
8	P25021_TP0	P25021	Histamine H2 receptor	blocker
9	Q9H3N8_TP0	Q9H3N8	Histamine H4 receptor	binder	Ki(nM) = 33.6
10	P41145_TP0	P41145	Kappa-type opioid receptor	agonist
11	P31645_TP0	P31645	Sodium-dependent serotonin transporter	inhibitor	Ki(nM) = 2.8
12	Q09470_TP0	Q09470	Potassium voltage-gated channel	inhibitor
13	Q99720_TP0	Q99720	Sigma non-opioid intracellular	agonist
14	P08913_TP0	P08913	Alpha-2A adrenergic receptor	antagonist	Ki(nM) = 114.0
15	P35368_TP0	P35368	Alpha-1B adrenergic receptor	antagonist
16	P28221_TP0	P28221	5-hydroxytryptamine receptor 1D	binder
17	P23975_TP0	P23975	Sodium-dependent noradrenaline transporter	inhibitor	Ki(nM) = 13.3
18	O43526_TP0	O43526	Potassium voltage-gated channel	inhibitor
19	P19652_TP0	P19652	Alpha-1-acid glycoprotein 2	n/a
20	P50406_TP0	P50406	5-hydroxytryptamine receptor 6	antagonist	Ki(nM) = 65.0
21	P28222_TP0	P28222	5-hydroxytryptamine receptor 1B	binder
22	P28335_TP0	P28335	5-hydroxytryptamine receptor 2C	antagonist	Ki(nM) = 18.0
23	Q16620_TP0	Q16620	BDNF/NT-3 growth factors	agonist
24	P35367_TP0	P35367	Histamine H1 receptor	antagonist	Ki(nM) = 0.67
25	P41143_TP0	P41143	Delta-type opioid receptor	agonist
26	P28223_TP0	P28223	5-hydroxytryptamine receptor 2A	antagonist
27	P09874_TP0	P09874	Poly [ADP-ribose] polymerase	n/a	IC50(nM) = 1650.0