Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MMP9 | P14780 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.37 |
| ▸ | HTT | P42858 | 2/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 2/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | THRB | P10828 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.34 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.34 |
| ▸ | NPC1 | O15118 | 2/20 | 0.33 |
| ▸ | RAB9A | P51151 | 2/20 | 0.33 |
| ▸ | RET | P07949 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | SLC5A1 | P13866 | 1/20 | 0.33 |
| ▸ | SLC5A2 | P31639 | 1/20 | 0.33 |
| ▸ | PDE4A | P27815 | 3/20 | 0.33 |
| ▸ | PDE4B | Q07343 | 3/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL8006270 | 0.86 | KMT2A (0.41) | MMP9ALDH1A1MEN1KMT2AKDM4E | |
| SCHEMBL8008270 | 0.79 | LMNA (0.54) | ALDH1A1LMNANPC1RAB9AMAPT | |
| SCHEMBL8006261 | 0.76 | MMP9 (0.36) | MMP9ALDH1A1THRBLMNAHPGD | |
| SCHEMBL8005538 | 0.75 | ROCK2 (0.41) | MMP9ALDH1A1LMNAHPGDROCK2 | |
| SCHEMBL473984 | 0.74 | ALDH1A1 (0.53) | ALDH1A1HTTL3MBTL1MEN1KMT2A | |
| SCHEMBL14748434 | 0.72 | PDE4A (0.50) | ALDH1A1HTTL3MBTL1MEN1KMT2A | |
| SCHEMBL5801556 | 0.70 | PDE4A (0.49) | PDE4APDE4BPDE4CPDE4D | |
| SCHEMBL8007094 | 0.69 | PDE4A (0.50) | MMP9PDE4APDE4BPDE4CPDE4D | |
| SCHEMBL19622266 | 0.69 | ALDH1A1 (0.47) | ALDH1A1MEN1KMT2ALMNAHPGD | |
| SCHEMBL837451 | 0.68 | ALDH1A1 (0.56) | ALDH1A1HTTL3MBTL1MEN1KMT2A |
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-2009111676-A2 | BORON-CONTAINING SMALL MOLECULES AS ANTI-INFLAMMATORY AGENTS | ANACOR PHARMACEUTICALS, INC (US) | 2009-09-11 | — | — | WO | disclosed |