Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSS | P25774 | 3/20 | 0.41 |
| ▸ | CTSK | P43235 | 3/20 | 0.41 |
| ▸ | KDM4D | Q6B0I6 | 1/20 | 0.39 |
| ▸ | CES2 | O00748 | 1/20 | 0.39 |
| ▸ | CES1 | P23141 | 1/20 | 0.39 |
| ▸ | AAK1 | Q2M2I8 | 2/20 | 0.39 |
| ▸ | PPARG | P37231 | 3/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | NCOA2 | Q15596 | 1/20 | 0.38 |
| ▸ | NCOA1 | Q15788 | 1/20 | 0.38 |
| ▸ | NCOA3 | Q9Y6Q9 | 1/20 | 0.38 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.38 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.37 |
| ▸ | ACE | P12821 | 1/20 | 0.37 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.36 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.35 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.35 |
| ▸ | PPARA | Q07869 | 3/20 | 0.35 |
| ▸ | JAK2 | O60674 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL8741363 | 0.89 | KDM4D (0.39) | CTSSCTSKKDM4DCES2CES1 | |
| SCHEMBL4177618 | 0.85 | CTSS (0.46) | CTSSCTSKPPARGPTPN1ACE | |
| SCHEMBL29571131 | 0.83 | CTSS (0.43) | CTSSCTSKKDM4DCES2CES1 | |
| SCHEMBL3822263 | 0.83 | CTSS (0.43) | CTSSCTSKKDM4DCES2CES1 | |
| SCHEMBL6439819 | 0.82 | CTSS (0.46) | CTSSCTSKAAK1PPARGLMNA | |
| SCHEMBL17041588 | 0.80 | TRPA1 (0.44) | CTSSCTSKKDM4DCES2CES1 | |
| SCHEMBL8912111 | 0.80 | CTSS (0.47) | CTSSCTSKCES2CES1PPARG | |
| SCHEMBL30765251 | 0.78 | CTSS (0.43) | CTSSCTSKCES2CES1AAK1 | |
| SCHEMBL3762203 | 0.78 | CTSS (0.43) | CTSSCTSKCES2CES1AAK1 | |
| SCHEMBL16680101 | 0.78 | CTSA (0.45) | CTSSCTSKKDM4DTSHRJAK2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0693485-B1 | Baccatin derivatives and processes for preparing the same | TANABE SEIYAKU CO (JP) | 1998-06-03 | — | — | EP | disclosed |
| US-5677470-A | CHEMICAL INTERMEDIATES; ANTITUMOR AGENTS | TANABE SEIYAKU CO., LTD. (JP) | 1997-10-14 | — | — | US | disclosed |
| EP-0693485-A2 | Baccatin derivatives and processes for preparing the same | TANABE SEIYAKU CO., LTD. (JP) | 1996-01-24 | — | — | EP | disclosed |