Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PKM | P14618 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.35 |
| ▸ | LMNA | P02545 | 4/20 | 0.34 |
| ▸ | MAPT | P10636 | 4/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 2/20 | 0.33 |
| ▸ | MGMT | P16455 | 2/20 | 0.33 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.32 |
| ▸ | CDK2 | P24941 | 1/20 | 0.32 |
| ▸ | CCNA1 | P78396 | 1/20 | 0.32 |
| ▸ | ATM | Q13315 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL5405453 | 0.85 | MAPT (0.49) | ALDH1A1SMN1; SMN2LMNAMAPTKMT2A | |
| SCHEMBL27930543 | 0.74 | PKM (0.44) | PKMALDH1A1SMN1; SMN2LMNAMAPT | |
| SCHEMBL15432578 | 0.74 | TDP1 (0.37) | ALDH1A1SMN1; SMN2LMNAMAPTKMT2A | |
| SCHEMBL9640554 | 0.73 | MGMT (0.49) | PKMALDH1A1SMN1; SMN2LMNAMAPT | |
| SCHEMBL257010 | 0.70 | ALDH1A1 (0.38) | PKMALDH1A1SMN1; SMN2LMNAMAPT | |
| SCHEMBL11834710 | 0.70 | PKM (0.44) | PKMALDH1A1SMN1; SMN2LMNAMAPT | |
| SCHEMBL10916212 | 0.69 | KMT2A (0.46) | PKMALDH1A1SMN1; SMN2LMNAMAPT | |
| Dimethyl Sulfoxide SCHEMBL28582516 | 0.69 | PKM (0.38) | PKMALDH1A1LMNATDP1HTT | |
| SCHEMBL28276642 | 0.69 | MGMT (0.38) | PKMALDH1A1SMN1; SMN2LMNAMAPT | |
| SCHEMBL15904221 | 0.67 | NOS3 (0.31) | — |
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-0084758-B1 | PYRIMIDIN DERIVATIVES ACTIVE AS PARASITICIDES | CIBA-GEIGY AG (CH) | 1986-02-12 | — | — | EP | disclosed |
| EP-0084758-A1 | Pyrimidin derivatives active as parasiticides | CIBA-GEIGY AG (CH) | 1983-08-03 | — | — | EP | disclosed |