Ang1005

InChIKey GBVKRUOMSUTVPW-AHNVSIPUSA-N Formula C257H308N32O79 PubChem CID 46884921 ChEMBL CHEMBL1089636

SMILES CC(=O)O[C@H]1C(=O)[C@@]2(C)[C@H]([C@H](OC(=O)c3ccccc3)[C@]3(O)C[C@H](OC(=O)[C@H](OC(=O)CCC(=O)NCCCC[C@H](NC(=O)CNC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)CNC(=O)CNC(=O)[C@H](Cc4ccc(O)cc4)NC(=O)[C@H](Cc4ccccc4)NC(=O)[C@H](Cc4ccccc4)NC(=O)[C@@H](NC(=O)CCC(=O)O[C@@H](C(=O)O[C@H]4C[C@@]5(O)[C@@H](OC(=O)c6ccccc6)[C@@H]6[C@]7(OC(C)=O)CO[C@@H]7C[C@H](O)[C@@]6(C)C(=O)[C@H](OC(C)=O)C(=C4C)C5(C)C)[C@@H](NC(=O)c4ccccc4)c4ccccc4)C(C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc4ccccc4)C(=O)N[C@@H](CCCCNC(=O)CCC(=O)O[C@@H](C(=O)O[C@H]4C[C@@]5(O)[C@@H](OC(=O)c6ccccc6)[C@@H]6[C@]7(OC(C)=O)CO[C@@H]7C[C@H](O)[C@@]6(C)C(=O)[C@H](OC(C)=O)C(=C4C)C5(C)C)[C@@H](NC(=O)c4ccccc4)c4ccccc4)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](Cc4ccc(O)cc4)C(=O)O)[C@@H](C)O)[C@@H](NC(=O)c4ccccc4)c4ccccc4)C(C)=C1C3(C)C)[C@]1(OC(C)=O)CO[C@@H]1C[C@@H]2O

Structure

2D skeletal formula · rendered by chemkit from PubChem 2D coordinates.

Protein targets · 16 targets

Prolow-density lipoprotein receptor-related protein 1 Q07954 · binding agent · Prolow-density lipoprotein receptor-related protein 1 binding agent
Tubulin beta-4B chain P68371 · inhibitor · Tubulin inhibitor
Tubulin beta-1 chain Q9H4B7 · inhibitor · Tubulin inhibitor
Tubulin alpha-3C chain P0DPH7 · inhibitor · Tubulin inhibitor
Tubulin alpha-4A chain P68366 · inhibitor · Tubulin inhibitor
Tubulin beta-3 chain Q13509 · inhibitor · Tubulin inhibitor
Tubulin alpha-1A chain Q71U36 · inhibitor · Tubulin inhibitor
Tubulin beta-4A chain P04350 · inhibitor · Tubulin inhibitor
Tubulin beta-8 chain Q3ZCM7 · inhibitor · Tubulin inhibitor
Tubulin beta chain P07437 · inhibitor · Tubulin inhibitor
Tubulin alpha-1B chain P68363 · inhibitor · Tubulin inhibitor
Tubulin alpha-1C chain Q9BQE3 · inhibitor · Tubulin inhibitor
Tubulin alpha-3E chain Q6PEY2 · inhibitor · Tubulin inhibitor
Tubulin beta-2A chain Q13885 · inhibitor · Tubulin inhibitor
Tubulin beta-2B chain Q9BVA1 · inhibitor · Tubulin inhibitor
Tubulin beta-6 chain Q9BUF5 · inhibitor · Tubulin inhibitor

Each resolved target links to its lmmol protein document; action and mechanism are from the bioactivity record.

A document in the lmmol reference corpus — a real compound (PubChem / ChEMBL identity, chemkit-rendered structure) cross-linked to the protein documents it targets. Hover any link to preview its target.