Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KIF11 | P52732 | 4/20 | 0.48 |
| ▸ | TRPV6 | Q9H1D0 | 2/20 | 0.48 |
| ▸ | CES2 | O00748 | 1/20 | 0.48 |
| ▸ | CES1 | P23141 | 1/20 | 0.48 |
| ▸ | ORAI1 | Q96D31 | 1/20 | 0.48 |
| ▸ | ORAI2 | Q96SN7 | 1/20 | 0.48 |
| ▸ | ORAI3 | Q9BRQ5 | 1/20 | 0.48 |
| ▸ | MGLL | Q99685 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.43 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.43 |
| ▸ | HTR3B | O95264 | 1/20 | 0.43 |
| ▸ | PLAU | P00749 | 1/20 | 0.43 |
| ▸ | HTR3A | P46098 | 1/20 | 0.43 |
| ▸ | HTR3D | Q70Z44 | 1/20 | 0.43 |
| ▸ | HTR3C | Q8WXA8 | 1/20 | 0.43 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.41 |
| ▸ | GSK3B | P49841 | 2/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL20140756 | 0.80 | ALDH1A1 (0.48) | KIF11TRPV6CES2CES1ORAI1 | |
| SCHEMBL63468 | 0.78 | ALDH1A1 (0.67) | KIF11TRPV6CES2CES1ORAI1 | |
| SCHEMBL28302381 | 0.73 | KIF11 (0.55) | KIF11TRPV6CES2CES1ORAI1 | |
| SCHEMBL16004702 | 0.72 | HPGD (0.55) | ALDH1A1TSHRCYP1A2 | |
| SCHEMBL8389817 | 0.72 | LMNA (0.55) | KIF11ALDH1A1TSHRSRD5A2CYP1A2 | |
| SCHEMBL19434332 | 0.72 | ALDH1A1 (0.59) | KIF11TRPV6CES2CES1ORAI1 | |
| SCHEMBL21724856 | 0.72 | ALDH1A1 (0.40) | KIF11TRPV6CES2CES1ORAI1 | |
| Bromide SCHEMBL29093544 | 0.72 | ALDH1A1 (0.59) | KIF11TRPV6CES2CES1ORAI1 | |
| Iodide SCHEMBL29093539 | 0.72 | ALDH1A1 (0.59) | KIF11TRPV6CES2CES1ORAI1 | |
| SCHEMBL57109 | 0.71 | KIF11 (0.84) | KIF11TRPV6CES2CES1ORAI1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1461373-A1 | POLYMERIC COMPOSITIONS AND USES THEREFORE | SUMITOMO BAKELITE CO., LTD. (JP) | 2004-09-29 | — | — | EP | disclosed |
| WO-2003050158-A1 | POLYMERIC COMPOSITIONS AND USES THEREFOR | SUMITOMO BAKELITE CO., LTD. (US) | 2003-06-19 | — | — | WO | disclosed |