Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.67 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.67 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.67 |
| ▸ | GAA | P10253 | 2/20 | 0.67 |
| ▸ | HTT | P42858 | 2/20 | 0.67 |
| ▸ | HPGD | P15428 | 2/20 | 0.67 |
| ▸ | HDAC6 | Q9UBN7 | 7/20 | 0.60 |
| ▸ | HDAC1 | Q13547 | 4/20 | 0.60 |
| ▸ | HDAC8 | Q9BY41 | 3/20 | 0.60 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.60 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.60 |
| ▸ | HDAC7 | Q8WUI4 | 2/20 | 0.60 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.60 |
| ▸ | HDAC10 | Q969S8 | 2/20 | 0.60 |
| ▸ | HDAC11 | Q96DB2 | 2/20 | 0.60 |
| ▸ | HDAC9 | Q9UKV0 | 2/20 | 0.60 |
| ▸ | HDAC5 | Q9UQL6 | 2/20 | 0.60 |
| ▸ | MEN1 | O00255 | 3/20 | 0.59 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.59 |
| ▸ | PKM | P14618 | 2/20 | 0.59 |
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 | |
|---|---|---|---|---|
| SCHEMBL6490997 | 0.81 | KDM4E (1.00) | ALDH1A1KDM4EHSD17B10GAAHTT | |
| SCHEMBL30988184 | 0.74 | HDAC6 (0.52) | ALDH1A1KDM4EHSD17B10GAAHTT | |
| SCHEMBL3532448 | 0.74 | KDM4E (0.70) | ALDH1A1KDM4EHSD17B10GAAHTT | |
| SCHEMBL5943810 | 0.73 | HPSE (0.75) | ALDH1A1KDM4EGAAHPGDHDAC6 | |
| SCHEMBL7274899 | 0.73 | ALDH1A1 (0.68) | ALDH1A1KDM4EHSD17B10GAAHTT | |
| SCHEMBL28479646 | 0.73 | KDM4E (0.72) | ALDH1A1KDM4EHSD17B10GAAHTT | |
| SCHEMBL3612939 | 0.72 | HDAC6 (0.57) | ALDH1A1KDM4EHSD17B10HDAC6HDAC1 | |
| SCHEMBL6648776 | 0.71 | NPC1 (0.76) | ALDH1A1KDM4EHSD17B10GAAHTT | |
| SCHEMBL12047247 | 0.70 | KDM4E (0.72) | ALDH1A1KDM4EHSD17B10GAAHTT | |
| SCHEMBL8239304 | 0.70 | HDAC1 (0.55) | ALDH1A1KDM4EGAAHTTHDAC6 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3416633-A1 | TETRAHYDROQUINOLINE SUBSTITUTED HYDROXAMIC ACIDS AS SELECTIVE HISTONE DEACETYLASE 6 INHIBITORS | The Board of Trustees of the University of Illinois (US) | 2018-12-26 | — | — | EP | disclosed |
| WO-2017142883-A1 | TETRAHYDROQUINOLINE SUBSTITUTED HYDROXAMIC ACIDS AS SELECTIVE HISTONE DEACETYLASE 6 INHIBITORS | THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) | 2017-08-24 | — | — | WO | disclosed |