Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TUBB1 | Q9H4B7 | 1/20 | 0.41 |
| ▸ | MMP2 | P08253 | 8/20 | 0.40 |
| ▸ | MMP3 | P08254 | 6/20 | 0.40 |
| ▸ | MMP1 | P03956 | 2/20 | 0.39 |
| ▸ | CTSL | P07711 | 1/20 | 0.39 |
| ▸ | CTSB | P07858 | 1/20 | 0.39 |
| ▸ | ADAM17 | P78536 | 1/20 | 0.39 |
| ▸ | PSMB5 | P28074 | 1/20 | 0.39 |
| ▸ | MMP9 | P14780 | 1/20 | 0.39 |
| ▸ | MMP14 | P50281 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL57848 | 1.00 | TUBB1 (0.41) | TUBB1MMP2MMP3MMP1CTSL | |
| SCHEMBL58285 | 0.83 | TUBB1 (0.59) | TUBB1MMP2MMP3MMP1CTSL | |
| SCHEMBL13660112 | 0.83 | TUBB1 (0.59) | TUBB1MMP2MMP3MMP1CTSL | |
| SCHEMBL13660111 | 0.82 | TUBB1 (0.57) | TUBB1MMP2MMP3MMP1ADAM17 | |
| SCHEMBL6806419 | 0.82 | TUBB1 (0.57) | TUBB1MMP2MMP3MMP1ADAM17 | |
| Trifluoroacetic Acid SCHEMBL6810659 | 0.80 | TUBB1 (0.53) | TUBB1MMP2MMP3MMP1ADAM17 | |
| SCHEMBL57849 | 0.80 | TUBB1 (0.48) | TUBB1MMP2MMP3MMP1ADAM17 | |
| SCHEMBL14567809 | 0.80 | TUBB1 (0.48) | TUBB1MMP2MMP3MMP1ADAM17 | |
| SCHEMBL13751416 | 0.80 | TUBB1 (0.48) | TUBB1MMP2MMP3MMP1ADAM17 | |
| SCHEMBL13660113 | 0.76 | TUBB1 (0.43) | TUBB1MMP2MMP3MMP1ADAM17 |
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 3 patents. 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 |
| US-7192972-B2 | Hemiasterlin derivatives and uses thereof | EISAI CO., LTD. (JP) | 2007-03-20 | — | — | US | disclosed |
| US-7192972-B2 | Hemiasterlin derivatives and uses thereof | EISAI CO., LTD. (JP) | 2007-03-20 | — | — | US | disclosed |