Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.54 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.51 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.49 |
| ▸ | NPC1 | O15118 | 2/20 | 0.48 |
| ▸ | RAB9A | P51151 | 2/20 | 0.48 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.48 |
| ▸ | TP53 | P04637 | 2/20 | 0.48 |
| ▸ | EPHX2 | P34913 | 2/20 | 0.47 |
| ▸ | LMNA | P02545 | 2/20 | 0.46 |
| ▸ | POLB | P06746 | 2/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL21611301 | 0.89 | ALDH1A1 (0.60) | TAAR1SMN1; SMN2NPSR1ALDH1A1NPC1 | |
| SCHEMBL13873709 | 0.82 | TAAR1 (0.49) | TAAR1SMN1; SMN2NPC1RAB9AEPHX2 | |
| SCHEMBL13873765 | 0.79 | EPHX2 (0.55) | TAAR1EPHX2 | |
| SCHEMBL13873793 | 0.78 | EPHX2 (0.57) | TAAR1ALDH1A1L3MBTL1EPHX2LMNA | |
| SCHEMBL13873827 | 0.78 | EPHX2 (0.53) | ALDH1A1EPHX2TSHR | |
| SCHEMBL13873727 | 0.77 | TAAR1 (0.47) | TAAR1SMN1; SMN2NPC1RAB9ATP53 | |
| SCHEMBL13745556 | 0.77 | SMN1; SMN2 (0.60) | TAAR1SMN1; SMN2NPC1RAB9ATP53 | |
| SCHEMBL13873879 | 0.77 | EPHX2 (0.60) | TAAR1SMN1; SMN2ALDH1A1NPC1RAB9A | |
| SCHEMBL13873847 | 0.77 | CYP2C9 (0.54) | TAAR1SMN1; SMN2NPC1RAB9ATP53 | |
| SCHEMBL13873862 | 0.77 | MEN1 (0.54) | L3MBTL1POLBMEN1KMT2A |
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-2018081167-A1 | COMPOUNDS AND USES THEREOF | YUMANITY THERAPEUTICS (US) | 2018-05-03 | — | — | WO | disclosed |