Ligand name: TAXOL
PDB ligand accession: TA1
DrugBank: DB01229
PubChem: 36314
ChEMBL: CHEMBL428647
InChI Key: RCINICONZNJXQF-MZXODVADSA-N
SMILES: CC1=C2C(C(=O)C3(C(CC4C(C3C(C(C2(C)C)(CC1OC(=O)C(C(c5ccccc5)NC(=O)c6ccccc6)O)O)OC(=O)c7ccccc7)(CO4)OC(=O)C)O)C)OC(=O)C

ClassyFire chemical classification:

List of proteins that are targets for TA1

# DrugDomain Data UniProt Accession Protein name Drug Action Affinity data
1 P08183_TA1 P08183 ATP-dependent translocase ABCB1 n/a IC50(nM) = 2596.0
2 P27816_TA1 P27816 Microtubule-associated protein 4 n/a
3 P10636_TA1 P10636 Microtubule-associated protein tau n/a
4 P04690_TA1 P04690 Tubulin beta-1/beta-2 chain n/a
5 P10415_TA1 P10415 Apoptosis regulator Bcl-2 inhibitor
6 A0A452DIL8_TA1 A0A452DIL8 Tubulin beta 4B n/a
7 P07437_TA1 P07437 Tubulin beta chain n/a
8 Q9H4B7_TA1 Q9H4B7 Tubulin beta-1 chain inhibitor
9 F2Z5B2_TA1 F2Z5B2 deleted n/a
10 O75469_TA1 O75469 Nuclear receptor subfamily inducer
11 A0A2K5HGL3_TA1 A0A2K5HGL3 Tubulin beta chain n/a
12 P02554_TA1 P02554 Tubulin beta chain n/a EC50(nM) = 520.0
13 Q6B856_TA1 Q6B856 Tubulin beta-2B chain n/a
14 E1BJB1_TA1 E1BJB1 Tubulin beta chain n/a
15 P02557_TA1 P02557 Tubulin beta chain n/a
16 A0A287AGU7_TA1 A0A287AGU7 Tubulin beta chain n/a