Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TUBB1 | Q9H4B7 | 2/20 | 0.47 |
| ▸ | DPP7 | Q9UHL4 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | GHSR | Q92847 | 1/20 | 0.31 |
| ▸ | PRCP | P42785 | 1/20 | 0.31 |
| ▸ | CTSC | P53634 | 2/20 | 0.30 |
| ▸ | CTSK | P43235 | 1/20 | 0.30 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.30 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.30 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.30 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.30 |
| ▸ | ADAM17 | P78536 | 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 | |
|---|---|---|---|---|
| SCHEMBL88616 | 1.00 | TUBB1 (0.47) | TUBB1DPP7CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL17733995 | 1.00 | TUBB1 (0.47) | TUBB1DPP7CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL57950 | 1.00 | TUBB1 (0.47) | TUBB1DPP7CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL13681965 | 1.00 | TUBB1 (0.47) | TUBB1DPP7CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL57429 | 1.00 | TUBB1 (0.47) | TUBB1DPP7CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL27400494 | 0.89 | TUBB1 (0.52) | TUBB1DPP7CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL10176577 | 0.87 | TUBB1 (0.61) | TUBB1DPP7CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL13681967 | 0.87 | TUBB1 (0.61) | TUBB1DPP7CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL13681966 | 0.87 | TUBB1 (0.61) | TUBB1DPP7CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL57626 | 0.87 | TUBB1 (0.61) | TUBB1DPP7CYP3A4CYP2D6CYP2C9 |
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 |
|---|---|---|---|---|---|---|---|
| US-8633224-B2 | Hemiasterlin derivatives and uses thereof in the treatment of cancer | EISAI CO., LTD. (JP) | 2014-01-21 | — | — | US | disclosed |