Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | MIF | P14174 | 1/20 | 0.39 |
| ▸ | TRPA1 | O75762 | 2/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | MPO | P05164 | 1/20 | 0.38 |
| ▸ | NOS2 | P35228 | 3/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.35 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.35 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.35 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.35 |
| ▸ | HKDC1 | Q2TB90 | 1/20 | 0.34 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.33 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.33 |
| ▸ | HTR2A | P28223 | 1/20 | 0.33 |
| ▸ | HRH1 | P35367 | 1/20 | 0.33 |
| ▸ | PBRM1 | Q86U86 | 1/20 | 0.33 |
| ▸ | NOS3 | P29474 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL13001836 | 0.81 | ESR1 (0.50) | LMNACYP2D6SLC6A2MEN1KMT2A | |
| Water SCHEMBL28681973 | 0.80 | TSHR (0.38) | TRPA1TSHRNOS2CYP2D6SLC6A2 | |
| SCHEMBL28918171 | 0.77 | SMN1; SMN2 (0.46) | TSHRCYP2D6SLC6A2SLC6A4SMN1; SMN2 | |
| SCHEMBL777528 | 0.76 | LMNA (0.50) | LMNAMIFTRPA1MPONOS2 | |
| SCHEMBL577034 | 0.76 | LMNA (0.50) | LMNAMIFTRPA1TSHRMPO | |
| SCHEMBL13654815 | 0.74 | LMNA (0.48) | LMNAMIFTRPA1MPONOS2 | |
| SCHEMBL29346087 | 0.72 | LMNA (0.46) | LMNAMIFTRPA1TSHRMPO | |
| SCHEMBL2936982 | 0.72 | TRPA1 (0.41) | LMNAMIFTRPA1TSHRCYP2D6 | |
| SCHEMBL777529 | 0.72 | LMNA (0.46) | LMNAMIFTRPA1MPONOS2 | |
| SCHEMBL12381822 | 0.72 | LMNA (0.46) | LMNAMIFTRPA1TSHRMPO |
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 |
|---|---|---|---|---|---|---|---|
| EP-2252612-B1 | HETEROCYCLIC COMPOUNDS AND COMPOSITIONS AS C-KIT AND PDGFR KINASE INHIBITORS | IRM LLC (BM) | 2012-03-28 | — | — | EP | disclosed |