Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC3 | O15379 | 5/20 | 0.48 |
| ▸ | HDAC6 | Q9UBN7 | 5/20 | 0.48 |
| ▸ | HDAC1 | Q13547 | 4/20 | 0.48 |
| ▸ | HDAC7 | Q8WUI4 | 4/20 | 0.48 |
| ▸ | HDAC8 | Q9BY41 | 4/20 | 0.48 |
| ▸ | HDAC4 | P56524 | 3/20 | 0.48 |
| ▸ | HDAC2 | Q92769 | 3/20 | 0.48 |
| ▸ | HDAC9 | Q9UKV0 | 3/20 | 0.48 |
| ▸ | HDAC5 | Q9UQL6 | 3/20 | 0.48 |
| ▸ | NCOR2 | Q9Y618 | 1/20 | 0.47 |
| ▸ | LOXL2 | Q9Y4K0 | 2/20 | 0.46 |
| ▸ | LIMK2 | P53671 | 1/20 | 0.43 |
| ▸ | F10 | P00742 | 1/20 | 0.42 |
| ▸ | HDAC10 | Q969S8 | 2/20 | 0.41 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | MLYCD | O95822 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL19634420 | 0.88 | MLYCD (0.49) | HDAC3HDAC6HDAC1HDAC7HDAC8 | |
| SCHEMBL7157289 | 0.86 | ALDH1A1 (0.48) | HDAC3HDAC6HDAC1HDAC7HDAC8 | |
| SCHEMBL10076244 | 0.81 | ALDH1A1 (0.52) | HDAC6HDAC1LIMK2NPC1ALDH1A1 | |
| SCHEMBL14117677 | 0.81 | CYP3A4 (0.43) | LIMK2CYP3A4NPC1ALDH1A1L3MBTL1 | |
| SCHEMBL5664687 | 0.81 | ALDH1A1 (0.42) | LIMK2CYP3A4NPC1ALDH1A1L3MBTL1 | |
| SCHEMBL21788015 | 0.80 | ALDH1A1 (0.53) | HDAC4LIMK2NPC1ALDH1A1L3MBTL1 | |
| SCHEMBL29616188 | 0.80 | LOXL2 (0.40) | HDAC3HDAC6HDAC1HDAC7HDAC8 | |
| SCHEMBL19634689 | 0.80 | MLYCD (0.54) | HDAC3HDAC6HDAC1HDAC7HDAC8 | |
| SCHEMBL19634699 | 0.80 | LOXL2 (0.49) | HDAC3HDAC6HDAC1HDAC7HDAC8 | |
| SCHEMBL19634392 | 0.79 | HPGD (0.58) | HDAC3HDAC6HDAC1NCOR2LOXL2 |
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-2017200984-A1 | NOVEL CYCLOSPORIN DERIVATIVES AND USES THEREOF | S&T GLOBAL INC. (US) | 2017-11-23 | — | — | WO | disclosed |