Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHEK1 | O14757 | 1/20 | 0.36 |
| ▸ | LIMK1 | P53667 | 1/20 | 0.36 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.36 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.33 |
| ▸ | GAA | P10253 | 2/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | RECQL | P46063 | 1/20 | 0.33 |
| ▸ | PKM | P14618 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 3/20 | 0.33 |
| ▸ | RAB9A | P51151 | 3/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 2/20 | 0.31 |
| ▸ | HTT | P42858 | 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 | |
|---|---|---|---|---|
| SCHEMBL11090827 | 0.71 | ALDH1A1 (0.43) | CHEK1LIMK1DYRK1ACLK4ALDH1A1 | |
| SCHEMBL11189040 | 0.69 | ALDH1A1 (0.46) | CHEK1LIMK1DYRK1ACLK4ALDH1A1 | |
| SCHEMBL18608538 | 0.69 | ALDH1A1 (0.58) | ALDH1A1HPGDKDM4EGAATSHR | |
| SCHEMBL4766087 | 0.68 | ALDH1A1 (0.47) | CHEK1LIMK1DYRK1ACLK4ALDH1A1 | |
| SCHEMBL760978 | 0.65 | RAB9A (0.66) | ALDH1A1HPGDKDM4EGAATSHR | |
| SCHEMBL18586632 | 0.59 | CHEK1 (0.41) | CHEK1LIMK1DYRK1ACLK4ALDH1A1 | |
| SCHEMBL11608555 | 0.58 | ACHE (0.41) | ALDH1A1HPGDKDM4EGAAPKM | |
| SCHEMBL18583110 | 0.58 | ALDH1A1 (0.55) | ALDH1A1HPGDKDM4EGAATSHR | |
| SCHEMBL11093011 | 0.58 | RXFP1 (0.45) | ALDH1A1HPGDKDM4ERECQLMAPT | |
| SCHEMBL11612897 | 0.58 | KDM4E (0.36) | CHEK1LIMK1DYRK1ACLK4ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| US-4456752-A | REACTING A HYDRAZINE WITH DIHALOGEN SUBSTITUTED PYRIDO(1,2-A)PYRIMIDINE | CHINOIN GYOGYSZER ES VEGYESZETI TERMEKEK GYARA R.T. (HU) | 1984-06-26 | — | — | US | disclosed |
| US-4452982-A | Process for the preparation of nitrogen-bridgehead condensed pyrimidine compounds, and pharmaceutical compositions containing them | CHINOIN GYOGYSZER ES VEGYESZETI TERMEKEK GYARA R.T. (HU) | 1984-06-05 | — | — | US | disclosed |