Ligand name: ACTINONIN
PDB ligand accession: BB2
DrugBank: DB04310
PubChem: 443600
ChEMBL: CHEMBL308333
InChI Key: XJLATMLVMSFZBN-VYDXJSESSA-N
SMILES: CCCCCC(CC(=O)NO)C(=O)NC(C(C)C)C(=O)N1CCCC1CO

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organic acids and derivatives
    • Class: Carboxylic acids and derivatives
      • Subclass: Amino acids, peptides, and analogues

List of proteins that are targets for DB04310

#	DrugDomain Data	UniProt Accession	Drug Action	Affinity data
1	Q2GI30_BB2	Q2GI30	n/a
2	Q9HBH1_BB2	Q9HBH1	n/a	Ki(nM) = 0.3 IC50(nM) = 1.5
3	Q9FUZ2_BB2	Q9FUZ2	n/a
4	Q819U0_BB2	Q819U0	n/a
5	O31410_BB2	O31410	n/a
6	Q93LE9_BB2	Q93LE9	n/a
7	B1FPK4_BB2	B1FPK4	n/a
8	Q9FV53_BB2	Q9FV53	n/a	IC50(nM) = 27.0
9	P68826_BB2	P68826	inhibitor	IC50(nM) = 5.0
10	A0A1C7BES9_BB2	A0A1C7BES9	n/a
11	Q8E378_BB2	Q8E378	n/a
12	A0A0J1A8B1_BB2	A0A0J1A8B1	n/a
13	A0A128NM93_BB2	A0A128NM93	n/a
14	Q82ZJ0_BB2	Q82ZJ0	n/a
15	O96935_BB2	O96935	n/a
16	Q385B0_BB2	Q385B0	n/a
17	E3SLL2_BB2	E3SLL2	n/a
18	P0A6K3_BB2	P0A6K3	n/a
19	P68771_BB2	P68771	n/a
20	Q672W7_BB2	Q672W7	n/a
21	Q6VT21_BB2	Q6VT21	n/a
22	Q13XB1_BB2	Q13XB1	n/a
23	Q5N5L5_BB2	Q5N5L5	n/a
24	Q819K2_BB2	Q819K2	n/a
25	P04825_BB2	P04825	n/a
26	P0AGG8_BB2	P0AGG8	n/a
27	A0A0H3KPJ9_BB2	A0A0H3KPJ9	n/a
28	Q5H3Z2_BB2	Q5H3Z2	n/a
29	Q4QMV6_BB2	Q4QMV6	n/a
30	Q4QH17_BB2	Q4QH17	n/a
31	A0A0E1FIJ3_BB2	A0A0E1FIJ3	n/a
32	Q9I7A8_BB2	Q9I7A8	n/a