Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MET | P08581 | 4/20 | 0.48 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.48 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.47 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.47 |
| ▸ | ALK | Q9UM73 | 3/20 | 0.46 |
| ▸ | MAP4K3 | Q8IVH8 | 5/20 | 0.45 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.43 |
| ▸ | CYP3A5 | P20815 | 2/20 | 0.43 |
| ▸ | CYP3A7 | P24462 | 2/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.43 |
| ▸ | PDK4 | Q16654 | 2/20 | 0.43 |
| ▸ | CYP3A43 | Q9HB55 | 2/20 | 0.43 |
| ▸ | MAP3K7 | O43318 | 1/20 | 0.43 |
| ▸ | TAB1 | Q15750 | 1/20 | 0.43 |
| ▸ | KHK | P50053 | 1/20 | 0.43 |
| ▸ | GRK5 | P34947 | 2/20 | 0.43 |
| ▸ | GRK2 | P25098 | 1/20 | 0.42 |
| ▸ | FLT3 | P36888 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL23015213 | 1.00 | MET (0.48) | METKCNH2CHRNB2CHRNA4ALK | |
| SCHEMBL23015372 | 0.88 | EGFR (0.49) | METNTRK1KHKFLT3JAK2 | |
| SCHEMBL29636681 | 0.88 | EGFR (0.49) | METNTRK1KHKFLT3JAK2 | |
| SCHEMBL29636726 | 0.80 | GRM2 (0.46) | MET | |
| SCHEMBL23015344 | 0.80 | GRM2 (0.46) | MET | |
| SCHEMBL23029690 | 0.79 | ACP1 (0.50) | ALKMAP4K3NTRK1 | |
| SCHEMBL29636642 | 0.79 | DHODH (0.45) | CYP1A2CYP2C19 | |
| SCHEMBL23015138 | 0.79 | DHODH (0.45) | CYP1A2CYP2C19 | |
| SCHEMBL29636644 | 0.76 | KMT2A (0.42) | CYP1A2CYP3A4CYP2C19 | |
| SCHEMBL28967174 | 0.76 | KMT2A (0.42) | CYP1A2CYP3A4CYP2C19 |
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-4017492-A1 | MOLECULES THAT BIND TO TDP-43 FOR THE TREATMENT OF AMYOTROPHIC LATERAL SCLEROSIS AND RELATED DISORDERS | Biohaven Therapeutics Ltd. (US) | 2022-06-29 | — | — | EP | claimed |