Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.70 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.70 |
| ▸ | GAA | P10253 | 3/20 | 0.62 |
| ▸ | MAPT | P10636 | 1/20 | 0.60 |
| ▸ | DHFR | P00374 | 1/20 | 0.59 |
| ▸ | ABCB1 | P08183 | 2/20 | 0.55 |
| ▸ | LMNA | P02545 | 2/20 | 0.55 |
| ▸ | POLB | P06746 | 1/20 | 0.54 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.52 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.52 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.51 |
| ▸ | NPC1 | O15118 | 1/20 | 0.51 |
| ▸ | RAB9A | P51151 | 1/20 | 0.51 |
| ▸ | EGFR | P00533 | 1/20 | 0.49 |
| ▸ | TSHR | P16473 | 1/20 | 0.49 |
| ▸ | ATM | Q13315 | 1/20 | 0.49 |
| ▸ | CA1 | P00915 | 1/20 | 0.49 |
| ▸ | CA2 | P00918 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL7695807 | 0.91 | GAA (0.63) | ALDH1A1SMN1; SMN2GAAMAPTDHFR | |
| SCHEMBL7696183 | 0.91 | MAPT (0.71) | ALDH1A1SMN1; SMN2GAAMAPTDHFR | |
| SCHEMBL7695378 | 0.86 | ALDH1A1 (0.67) | ALDH1A1SMN1; SMN2GAAMAPTDHFR | |
| SCHEMBL26598049 | 0.80 | DHFR (0.66) | ALDH1A1SMN1; SMN2GAAMAPTDHFR | |
| SCHEMBL10113073 | 0.76 | CA1 (0.74) | ALDH1A1SMN1; SMN2DHFRLMNACYP2C9 | |
| SCHEMBL10050565 | 0.76 | TSHR (0.68) | ALDH1A1SMN1; SMN2GAAMAPTDHFR | |
| SCHEMBL7696861 | 0.74 | ALDH1A1 (0.56) | ALDH1A1SMN1; SMN2GAAMAPTLMNA | |
| SCHEMBL13167285 | 0.73 | GAA (0.75) | ALDH1A1SMN1; SMN2GAAMAPTDHFR | |
| SCHEMBL7356688 | 0.72 | DHFR (0.74) | ALDH1A1SMN1; SMN2GAAMAPTDHFR | |
| SCHEMBL7356693 | 0.72 | DHFR (0.74) | ALDH1A1SMN1; SMN2GAAMAPTDHFR |
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-2002066443-A2 | 2-THIOXO-1,2,3,4-TETRAHYDROPYRIMIDINE DERIVATIVES | ONO PHARMACEUTICAL CO., LTD. (JP) | 2002-08-29 | — | — | WO | disclosed |