Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | WDR91 | A4D1P6 | 2/20 | 0.37 |
| ▸ | HDAC1 | Q13547 | 6/20 | 0.36 |
| ▸ | HDAC6 | Q9UBN7 | 3/20 | 0.36 |
| ▸ | BDKRB1 | P46663 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.34 |
| ▸ | CDC7 | O00311 | 1/20 | 0.34 |
| ▸ | PLK4 | O00444 | 1/20 | 0.34 |
| ▸ | AURKA | O14965 | 1/20 | 0.34 |
| ▸ | MAPK13 | O15264 | 1/20 | 0.34 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.34 |
| ▸ | DYRK3 | O43781 | 1/20 | 0.34 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.34 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.34 |
| ▸ | PAK4 | O96013 | 1/20 | 0.34 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.34 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.34 |
| ▸ | PRKCG | P05129 | 1/20 | 0.34 |
| ▸ | FYN | P06241 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL16623477 | 0.89 | BDKRB1 (0.36) | L3MBTL1WDR91HDAC1HDAC6BDKRB1 | |
| SCHEMBL17849208 | 0.87 | HDAC6 (0.33) | HDAC1HDAC6ALDH1A1SMN1; SMN2KMT2A | |
| SCHEMBL17849209 | 0.87 | BDKRB1 (0.35) | BDKRB1KDM4EALDH1A1SMN1; SMN2MEN1 | |
| SCHEMBL17849193 | 0.85 | F10 (0.43) | RAB9APRKAA1F10ALDH1A1SMN1; SMN2 | |
| SCHEMBL17849190 | 0.85 | LTA4H (0.33) | RAB9ANTRK1PARP1ALDH1A1 | |
| SCHEMBL17849238 | 0.85 | L3MBTL1 (0.38) | L3MBTL1WDR91HDAC1HDAC6BDKRB1 | |
| SCHEMBL17849189 | 0.84 | RAB9A (0.45) | RAB9AHRH3NTRK1KDM4EALDH1A1 | |
| SCHEMBL16623450 | 0.81 | NPC1 (0.32) | — | |
| SCHEMBL16726665 | 0.80 | ALDH2 (0.33) | KMT2A | |
| SCHEMBL16623587 | 0.79 | ROCK1 (0.39) | L3MBTL1HDAC1HDAC6RAB9ANTRK1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-9371320-B2 | Heterocyclic compound | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2016-06-21 | — | — | US | disclosed |
| US-9371320-B2 | Heterocyclic compound | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2016-06-21 | — | — | US | disclosed |