Known targets — ChEMBL curated mechanism
HDAC1HDAC10HDAC11HDAC2HDAC3HDAC4HDAC5HDAC6HDAC7HDAC8HDAC9
The experimentally established mechanism targets of Panobinostat. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 known ✓ | Q13547 | 20/20 | 0.98 |
| ▸ | HDAC2 known ✓ | Q92769 | 12/20 | 0.98 |
| ▸ | HDAC3 known ✓ | O15379 | 12/20 | 0.98 |
| ▸ | HDAC6 known ✓ | Q9UBN7 | 5/20 | 0.98 |
| ▸ | HDAC8 known ✓ | Q9BY41 | 5/20 | 0.98 |
| ▸ | HDAC4 known ✓ | P56524 | 4/20 | 0.98 |
| ▸ | HDAC7 known ✓ | Q8WUI4 | 3/20 | 0.98 |
| ▸ | HDAC10 known ✓ | Q969S8 | 3/20 | 0.98 |
| ▸ | HDAC11 known ✓ | Q96DB2 | 3/20 | 0.98 |
| ▸ | HDAC9 known ✓ | Q9UKV0 | 3/20 | 0.98 |
| ▸ | HDAC5 known ✓ | Q9UQL6 | 3/20 | 0.98 |
| ▸ | NCOR2 | Q9Y618 | 8/20 | 0.98 |
| ▸ | TET3 | O43151 | 1/20 | 0.98 |
| ▸ | BRD4 | O60885 | 1/20 | 0.98 |
| ▸ | FOXO1 | Q12778 | 1/20 | 0.98 |
| ▸ | TET2 | Q6N021 | 1/20 | 0.98 |
| ▸ | PIK3C3 | Q8NEB9 | 1/20 | 0.98 |
| ▸ | TET1 | Q8NFU7 | 1/20 | 0.98 |
| ▸ | KCNH2 | Q12809 | 5/20 | 0.77 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| Panobinostat SCHEMBL164801 | 0.99 | HDAC1 (1.00) | HDAC1HDAC2HDAC3NCOR2HDAC6 | |
| Panobinostat SCHEMBL183197 | 0.99 | HDAC1 (1.00) | HDAC1HDAC2HDAC3NCOR2HDAC6 | |
| Panobinostat SCHEMBL22773814 | 0.99 | HDAC1 (1.00) | HDAC1HDAC2HDAC3NCOR2HDAC6 | |
| Panobinostat SCHEMBL436875 | 0.98 | HDAC1 (0.98) | HDAC1HDAC2HDAC3NCOR2HDAC6 | |
| Panobinostat SCHEMBL30235437 | 0.93 | HDAC1 (0.87) | HDAC1HDAC2HDAC3NCOR2HDAC6 | |
| Panobinostat SCHEMBL29358399 | 0.93 | HDAC1 (0.87) | HDAC1HDAC2HDAC3NCOR2HDAC6 | |
| Panobinostat SCHEMBL2315056 | 0.93 | HDAC1 (0.87) | HDAC1HDAC2HDAC3NCOR2HDAC6 | |
| Panobinostat SCHEMBL2315067 | 0.93 | HDAC1 (0.87) | HDAC1HDAC2HDAC3NCOR2HDAC6 | |
| SCHEMBL10036755 | 0.92 | HDAC1 (0.86) | HDAC1HDAC2HDAC3NCOR2HDAC6 | |
| Panobinostat SCHEMBL2316088 | 0.92 | HDAC1 (0.86) | HDAC1HDAC2HDAC3NCOR2HDAC6 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2018092151-A1 | PROCESS FOR THE PREPARATION OF 2-(E)-N-HYDROXY-3-[4-[[[2-(2-METHYL-1H-INDOL-3-YL) ETHYL]AMINO]METHYL]PHENYL]-2-PROPENAMIDE 2-HYDROXYPROPANOIC ACID (1:1) AND ITS POLYMORPHS THEREOF | MSN LABORATORIES PRIVATE LIMITED, R&D CENTER (IN) | 2018-05-24 | — | — | WO | disclosed |