Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PPIB | P23284 | 4/20 | 0.43 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.42 |
| ▸ | PPID | Q08752 | 4/20 | 0.40 |
| ▸ | PPIG | Q13427 | 2/20 | 0.40 |
| ▸ | PPIA | P62937 | 1/20 | 0.40 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 2/20 | 0.36 |
| ▸ | CA12 | O43570 | 1/20 | 0.35 |
| ▸ | CA1 | P00915 | 1/20 | 0.35 |
| ▸ | CA2 | P00918 | 1/20 | 0.35 |
| ▸ | CA9 | Q16790 | 1/20 | 0.35 |
| ▸ | ITGB1 | P05556 | 1/20 | 0.35 |
| ▸ | ITGA5 | P08648 | 1/20 | 0.35 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.35 |
| ▸ | TPSAB1 | Q15661 | 1/20 | 0.35 |
| ▸ | CACNA1G | O43497 | 1/20 | 0.34 |
| ▸ | GFER | P55789 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL14100114 | 0.79 | TPSAB1 (0.50) | PPIBEPHX2PPIDPPIGPPIA | |
| SCHEMBL14619098 | 0.78 | PPIB (0.42) | PPIBEPHX2PPIDPPIGPPIA | |
| SCHEMBL24016408 | 0.73 | LSS (0.35) | PPIBEPHX2PPIDPPIGPPIA | |
| SCHEMBL23116511 | 0.71 | PPIB (0.44) | PPIBEPHX2PPIDPPIGPPIA | |
| SCHEMBL6415716 | 0.70 | EPHX2 (0.50) | PPIBEPHX2PPIDPPIGPPIA | |
| SCHEMBL19882179 | 0.69 | CA12 (0.49) | PPIBEPHX2PPIDPPIGPPIA | |
| SCHEMBL10856840 | 0.68 | PHLPP2 (0.43) | ALDH1A1CYP3A4TDP1 | |
| SCHEMBL1800569 | 0.68 | KMT2A (0.63) | PPIBEPHX2PPIDPPIGPPIA | |
| SCHEMBL14472553 | 0.68 | EPHX2 (0.44) | PPIBEPHX2PPIDPPIGPPIA | |
| SCHEMBL15940349 | 0.67 | ALOX12 (0.65) | ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2007018941-A2 | PYRIMIDYL-THIOPHENE DERIVATIVES | SMITHKLINE BEECHAM CORPORATION (US) | 2007-02-15 | — | — | WO | disclosed |