Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MT-CO2 | P00403 | 1/20 | 0.35 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 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 | |
|---|---|---|---|---|
| SCHEMBL16726696 | 0.88 | HDAC6 (0.41) | HDAC6KDM4E | |
| SCHEMBL17849206 | 0.82 | ALDH1A1 (0.40) | KDM4E | |
| SCHEMBL16726665 | 0.82 | ALDH2 (0.33) | — | |
| SCHEMBL16623450 | 0.81 | NPC1 (0.32) | — | |
| SCHEMBL17849208 | 0.79 | HDAC6 (0.33) | HDAC6 | |
| SCHEMBL16623547 | 0.79 | SYK (0.36) | KDM4E | |
| SCHEMBL16623588 | 0.79 | SYK (0.34) | — | |
| SCHEMBL16726674 | 0.79 | PRKAB2 (0.35) | — | |
| SCHEMBL17849211 | 0.78 | L3MBTL1 (0.38) | HDAC6KDM4E | |
| SCHEMBL16623587 | 0.78 | ROCK1 (0.39) | HDAC6KDM4E |
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 |