Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DDX3X | O00571 | 2/20 | 0.62 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.61 |
| ▸ | MAPT | P10636 | 1/20 | 0.61 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.61 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.61 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.61 |
| ▸ | MEN1 | O00255 | 2/20 | 0.61 |
| ▸ | LMNA | P02545 | 2/20 | 0.61 |
| ▸ | NPC1 | O15118 | 1/20 | 0.61 |
| ▸ | TP53 | P04637 | 1/20 | 0.58 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.58 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.58 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.58 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.58 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.58 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.58 |
| ▸ | GRIN3A | Q8TCU5 | 1/20 | 0.58 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.58 |
| ▸ | CA12 | O43570 | 1/20 | 0.56 |
| ▸ | CA1 | P00915 | 1/20 | 0.56 |
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 | |
|---|---|---|---|---|
| SCHEMBL11332310 | 0.90 | KMT2A (0.73) | ALDH1A1MAPTMAPK1SMN1; SMN2KMT2A | |
| SCHEMBL6504076 | 0.86 | TDP1 (0.64) | DDX3XALDH1A1MAPTMAPK1SMN1; SMN2 | |
| SCHEMBL13628346 | 0.83 | KMT2A (0.65) | ALDH1A1MAPTMAPK1SMN1; SMN2KMT2A | |
| SCHEMBL5852169 | 0.83 | LMNA (0.68) | ALDH1A1MAPTMAPK1SMN1; SMN2KMT2A | |
| SCHEMBL3460053 | 0.83 | DDX3X (0.68) | DDX3XALDH1A1MAPTMAPK1SMN1; SMN2 | |
| SCHEMBL1275926 | 0.82 | RAB9A (0.75) | DDX3XALDH1A1MAPTKMT2AMEN1 | |
| SCHEMBL4388940 | 0.82 | CXCR2 (0.78) | ALDH1A1MAPTMAPK1SMN1; SMN2KMT2A | |
| SCHEMBL1963164 | 0.81 | KMT2A (0.65) | ALDH1A1MAPK1KMT2AMEN1LMNA | |
| SCHEMBL5181163 | 0.81 | KMT2A (0.76) | ALDH1A1MAPTKMT2AMEN1LMNA | |
| SCHEMBL175272 | 0.81 | MEN1 (0.71) | ALDH1A1MAPTMAPK1KMT2AMEN1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-108794408-B | Pyrimidine phenylurea anti-tumor compound and preparation method and application thereof | 中国医科大学 | 2020-04-21 | — | — | CN | disclosed |