Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CXCR3 | P49682 | 16/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | MLYCD | O95822 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL7016853 | 0.84 | MLYCD (0.43) | CXCR3ALDH1A1MLYCD | |
| SCHEMBL7017597 | 0.83 | CXCR3 (0.44) | CXCR3ALDH1A1MLYCD | |
| SCHEMBL7020798 | 0.83 | KCNH2 (0.50) | CXCR3MLYCD | |
| SCHEMBL7023261 | 0.80 | ALDH1A1 (0.70) | ALDH1A1NPC1RAB9A | |
| SCHEMBL7023859 | 0.79 | ALDH1A1 (0.56) | ALDH1A1NPC1RAB9A | |
| SCHEMBL7016812 | 0.77 | TP53 (0.46) | ALDH1A1NPC1RAB9A | |
| SCHEMBL7018385 | 0.77 | TP53 (0.46) | ALDH1A1NPC1RAB9A | |
| SCHEMBL7014520 | 0.76 | ALDH1A1 (0.52) | ALDH1A1NPC1RAB9A | |
| SCHEMBL7100250 | 0.76 | MEN1 (0.60) | ALDH1A1RAB9A | |
| SCHEMBL7020723 | 0.76 | TP53 (0.43) | CXCR3MLYCDNPC1RAB9A |
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-2003106435-A1 | FUSED-RING PYRIMIDIN-4(3H)-ONE DERIVATIVES, PROCESSES FOR THE PREPARATION AND USES THEREOF | SANKYO COMPANY, LIMITED (JP) | 2003-12-24 | — | — | WO | disclosed |