Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.38 |
| ▸ | NPC1 | O15118 | 2/20 | 0.38 |
| ▸ | RAB9A | P51151 | 2/20 | 0.38 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 2/20 | 0.36 |
| ▸ | TSHR | P16473 | 3/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.35 |
| ▸ | ATM | Q13315 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | EGFR | P00533 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 3/20 | 0.34 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | IDO1 | P14902 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL10620683 | 0.80 | CA1 (0.46) | SMN1; SMN2NPC1RAB9ATRPA1POLB | |
| SCHEMBL10618095 | 0.78 | GAA (0.38) | SMN1; SMN2NPC1RAB9ATRPA1POLB | |
| SCHEMBL9313406 | 0.74 | POLB (0.56) | SMN1; SMN2NPC1RAB9APOLBCYP1A2 | |
| SCHEMBL30827320 | 0.74 | CA1 (0.54) | SMN1; SMN2NPC1RAB9APOLBMAPK1 | |
| SCHEMBL11133278 | 0.74 | CA1 (0.54) | SMN1; SMN2NPC1RAB9APOLBMAPK1 | |
| SCHEMBL93983 | 0.73 | IDO1 (0.58) | SMN1; SMN2TRPA1POLBCYP1A2TSHR | |
| SCHEMBL2951140 | 0.72 | TRPA1 (0.41) | SMN1; SMN2NPC1RAB9ATRPA1CYP1A2 | |
| SCHEMBL23378387 | 0.72 | NOS3 (0.38) | SMN1; SMN2NPC1RAB9ATRPA1CYP1A2 | |
| SCHEMBL11420427 | 0.72 | POLB (0.47) | SMN1; SMN2NPC1RAB9APOLBMAPK1 | |
| Ammonia Solution, Strong SCHEMBL793693 | 0.72 | IDO1 (0.56) | SMN1; SMN2TRPA1POLBCYP1A2TSHR |
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 |
|---|---|---|---|---|---|---|---|
| EP-2735567-B1 | HETEROCYCLIC SUBSTITUTED PYRIMIDINE COMPOUND | XUANZHU PHARMA CO LTD (CN) | 2016-10-26 | — | — | EP | disclosed |