Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX2 | P34913 | 3/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | MCHR1 | Q99705 | 12/20 | 0.41 |
| ▸ | ADRA2A | P08913 | 10/20 | 0.41 |
| ▸ | HRH1 | P35367 | 5/20 | 0.39 |
| ▸ | HTR2B | P41595 | 5/20 | 0.39 |
| ▸ | ADRA1A | P35348 | 3/20 | 0.39 |
| ▸ | CNR1 | P21554 | 1/20 | 0.38 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.38 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | CXCR3 | P49682 | 1/20 | 0.38 |
| ▸ | HTR1A | P08908 | 1/20 | 0.38 |
| ▸ | NPY5R | Q15761 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL6873414 | 1.00 | EPHX2 (0.43) | EPHX2ALDH1A1NPC1SMN1; SMN2MCHR1 | |
| SCHEMBL6867915 | 0.91 | EPHX2 (0.49) | EPHX2ALDH1A1NPC1SMN1; SMN2MCHR1 | |
| SCHEMBL6867921 | 0.91 | EPHX2 (0.49) | EPHX2ALDH1A1NPC1SMN1; SMN2MCHR1 | |
| SCHEMBL6868638 | 0.91 | EPHX2 (0.54) | EPHX2ALDH1A1NPC1SMN1; SMN2MCHR1 | |
| SCHEMBL6876710 | 0.88 | MCHR1 (0.50) | EPHX2NPC1MCHR1ADRA2AHRH1 | |
| SCHEMBL6876707 | 0.88 | MCHR1 (0.50) | EPHX2NPC1MCHR1ADRA2AHRH1 | |
| SCHEMBL6876522 | 0.87 | MCHR1 (0.44) | NPC1MCHR1ADRA2AHRH1HTR2B | |
| SCHEMBL6876530 | 0.87 | MCHR1 (0.44) | NPC1MCHR1ADRA2AHRH1HTR2B | |
| SCHEMBL6456647 | 0.86 | TP53 (0.41) | ALDH1A1SMN1; SMN2MCHR1ADRA2AHRH1 | |
| SCHEMBL6456641 | 0.86 | TP53 (0.41) | ALDH1A1SMN1; SMN2MCHR1ADRA2AHRH1 |
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-1464335-A2 | Quinoline, tetrahydroquinoline and pyrimidine derivatives as mch antagonist | Taisho Pharmaceutical Co. Ltd. (JP) | 2004-10-06 | — | — | EP | disclosed |