Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 6/20 | 0.49 |
| ▸ | KLF5 | Q13887 | 1/20 | 0.49 |
| ▸ | RAB9A | P51151 | 6/20 | 0.49 |
| ▸ | LMNA | P02545 | 2/20 | 0.49 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.49 |
| ▸ | TP53 | P04637 | 3/20 | 0.48 |
| ▸ | TRPV4 | Q9HBA0 | 1/20 | 0.44 |
| ▸ | NCS1 | P62166 | 1/20 | 0.43 |
| ▸ | CSNK1D | P48730 | 1/20 | 0.42 |
| ▸ | DCLK1 | O15075 | 1/20 | 0.41 |
| ▸ | FES | P07332 | 1/20 | 0.41 |
| ▸ | PIM1 | P11309 | 1/20 | 0.41 |
| ▸ | CDK2 | P24941 | 1/20 | 0.41 |
| ▸ | GSK3A | P49840 | 1/20 | 0.41 |
| ▸ | GSK3B | P49841 | 1/20 | 0.41 |
| ▸ | IRAK1 | P51617 | 1/20 | 0.41 |
| ▸ | MAP4K2 | Q12851 | 1/20 | 0.41 |
| ▸ | NTRK3 | Q16288 | 1/20 | 0.41 |
| ▸ | HIPK4 | Q8NE63 | 1/20 | 0.41 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL18230271 | 0.89 | NOX1 (0.40) | NPC1RAB9ALMNATRPV4MAPT | |
| SCHEMBL18230364 | 0.86 | ADORA2A (0.42) | NPC1RAB9ATRPV4NCS1CSNK1D | |
| SCHEMBL18230507 | 0.85 | PCSK9 (0.48) | NPC1RAB9ATRPV4MEN1KMT2A | |
| SCHEMBL18230409 | 0.85 | ADORA2A (0.50) | LMNATRPV4MAPTSMN1; SMN2ALDH1A1 | |
| SCHEMBL18230472 | 0.81 | RAB9A (0.46) | NPC1RAB9ATP53TRPV4NCS1 | |
| SCHEMBL18094527 | 0.80 | MAPT (0.51) | NPC1KLF5RAB9ALMNANPSR1 | |
| SCHEMBL18230411 | 0.79 | ADORA3 (0.61) | NPC1RAB9ATRPV4MAPTKDM4E | |
| SCHEMBL18230282 | 0.79 | TRPV4 (0.56) | NPC1RAB9ATRPV4MAPTKDM4E | |
| SCHEMBL18230432 | 0.78 | ADORA3 (0.46) | LMNATP53TRPV4MAPT | |
| SCHEMBL18230342 | 0.78 | ADORA2A (0.44) | LMNANPSR1TP53TRPV4MAPT |
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-2016183173-A1 | ANTIPARASITIC COMPOUNDS | Avista Pharma Solutions (US) | 2016-11-17 | — | — | WO | disclosed |