Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DGAT1 | O75907 | 3/20 | 0.33 |
| ▸ | EGFR | P00533 | 2/20 | 0.31 |
| ▸ | ROCK1 | Q13464 | 2/20 | 0.31 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.31 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.31 |
| ▸ | MAPK7 | Q13164 | 1/20 | 0.31 |
| ▸ | F10 | P00742 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 2/20 | 0.30 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.30 |
| ▸ | MPI | P34949 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.30 |
| ▸ | JAK2 | O60674 | 1/20 | 0.30 |
| ▸ | JAK1 | P23458 | 1/20 | 0.30 |
| ▸ | TYK2 | P29597 | 1/20 | 0.30 |
| ▸ | JAK3 | P52333 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL16623587 | 0.90 | ROCK1 (0.39) | DGAT1ROCK1NTRK1MAPK7MAPT | |
| SCHEMBL17849203 | 0.88 | ROCK1 (0.40) | DGAT1ROCK1NTRK1MAPK7MAPT | |
| SCHEMBL17849212 | 0.83 | ITGB3 (0.37) | F10MEN1KMT2A | |
| SCHEMBL17849193 | 0.82 | F10 (0.43) | F10MAPTALDH1A1 | |
| SCHEMBL17849189 | 0.80 | RAB9A (0.45) | NTRK1KDM4EALDH1A1 | |
| SCHEMBL17849207 | 0.80 | ROCK1 (0.39) | ROCK1NTRK1MAPK7MAPTKDM4E | |
| SCHEMBL17849219 | 0.80 | RAF1 (0.42) | ROCK1NTRK1MAPTKDM4EMEN1 | |
| SCHEMBL17849202 | 0.80 | SMN1; SMN2 (0.44) | MAPK7MAPTKDM4EMEN1ALDH1A1 | |
| SCHEMBL17849208 | 0.78 | HDAC6 (0.33) | MAPTALDH1A1KMT2A | |
| SCHEMBL17849214 | 0.78 | TYK2 (0.38) | ROCK1MAPTKDM4EALDH1A1MAPK1 |
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 |