Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PELI1 | Q96FA3 | 2/20 | 0.46 |
| ▸ | ERN1 | O75460 | 6/20 | 0.45 |
| ▸ | PLG | P00747 | 1/20 | 0.40 |
| ▸ | PLAU | P00749 | 1/20 | 0.40 |
| ▸ | PLAT | P00750 | 1/20 | 0.40 |
| ▸ | KLK1 | P06870 | 1/20 | 0.40 |
| ▸ | HSD17B1 | P14061 | 1/20 | 0.38 |
| ▸ | HSD17B2 | P37059 | 1/20 | 0.38 |
| ▸ | PTGER2 | P43116 | 1/20 | 0.36 |
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.35 |
| ▸ | TOP2A | P11388 | 2/20 | 0.35 |
| ▸ | ESR2 | Q92731 | 3/20 | 0.34 |
| ▸ | ALDH5A1 | P51649 | 1/20 | 0.33 |
| ▸ | ABAT | P80404 | 1/20 | 0.33 |
| ▸ | ESR1 | P03372 | 2/20 | 0.33 |
| ▸ | GSK3B | P49841 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | CA12 | O43570 | 1/20 | 0.32 |
| ▸ | AKR1B10 | O60218 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL9300402 | 0.78 | P2RY14 (0.44) | PELI1PLGPLAUPLATKLK1 | |
| SCHEMBL9301988 | 0.77 | TOP2A (0.40) | PELI1ERN1PLGPLAUPLAT | |
| SCHEMBL7816757 | 0.75 | ALOX5 (0.49) | PELI1ERN1HSD17B1HSD17B2 | |
| SCHEMBL9301220 | 0.74 | PTGER2 (0.43) | PELI1PLGPLAUPLATKLK1 | |
| SCHEMBL27823275 | 0.69 | ERN1 (0.53) | PELI1ERN1GPR84TOP2ACA12 | |
| SCHEMBL9261782 | 0.69 | CA12 (0.67) | KDM4ECA12ALDH1A1LMNAALDH2 | |
| SCHEMBL9140612 | 0.65 | TLR8 (0.57) | PELI1HSD17B1HSD17B2PTGER2TOP2A | |
| SCHEMBL29794356 | 0.64 | ALDH5A1 (0.58) | HSD17B1HSD17B2ESR2ALDH5A1ABAT | |
| SCHEMBL658295 | 0.64 | ALDH5A1 (0.58) | HSD17B1HSD17B2ESR2ALDH5A1ABAT | |
| SCHEMBL31473053 | 0.64 | ALDH5A1 (0.58) | HSD17B1HSD17B2ESR2ALDH5A1ABAT |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5308852-A | Cardiovascular disorders | MERCK FROSST CANADA, INC. (CA) | 1994-05-03 | — | — | US | disclosed |
| EP-0579304-A1 | Heteroarylnaphthalenes as inhibitors of leukotriene biosynthesis | MERCK FROSST CANADA INC. (CA) | 1994-01-19 | — | — | EP | disclosed |
| WO-1994000444-A1 | HETEROARYLNAPHTHALENES AS INHIBITORS OF LEUKOTRIENE BIOSYNTHESIS | MERCK FROSST CANADA INC. (CA) | 1994-01-06 | — | — | WO | disclosed |