Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 2/20 | 0.63 |
| ▸ | NR4A2 | P43354 | 3/20 | 0.55 |
| ▸ | KIF11 | P52732 | 1/20 | 0.55 |
| ▸ | ASH1L | Q9NR48 | 1/20 | 0.54 |
| ▸ | RAB9A | P51151 | 2/20 | 0.54 |
| ▸ | PDE4A | P27815 | 1/20 | 0.53 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.53 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.53 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.53 |
| ▸ | PARP1 | P09874 | 3/20 | 0.51 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.50 |
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.49 |
| ▸ | HPGD | P15428 | 1/20 | 0.49 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.49 |
| ▸ | EIF2AK2 | P19525 | 1/20 | 0.47 |
| ▸ | IMPDH2 | P12268 | 1/20 | 0.47 |
| ▸ | CA12 | O43570 | 1/20 | 0.46 |
| ▸ | CA1 | P00915 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL1553838 | 1.00 | NPC1 (0.63) | NPC1NR4A2KIF11ASH1LRAB9A | |
| SCHEMBL14120820 | 0.87 | GPR84 (0.60) | NPC1NR4A2KIF11RAB9AGPR84 | |
| SCHEMBL29287217 | 0.86 | PDE4A (0.49) | NPC1NR4A2KIF11ASH1LRAB9A | |
| SCHEMBL12209328 | 0.84 | IMPDH2 (0.64) | NPC1RAB9APDE4APDE4BPDE4C | |
| SCHEMBL6418495 | 0.84 | NR4A2 (0.72) | NPC1NR4A2KIF11ASH1LRAB9A | |
| SCHEMBL21824109 | 0.83 | GABRA1 (0.49) | NPC1NR4A2KIF11ASH1LRAB9A | |
| SCHEMBL2804991 | 0.83 | NPC1 (0.62) | NPC1NR4A2KIF11ASH1LRAB9A | |
| SCHEMBL146334 | 0.83 | NPC1 (0.62) | NPC1NR4A2KIF11ASH1LRAB9A | |
| SCHEMBL3878724 | 0.83 | NPC1 (0.62) | NPC1NR4A2KIF11ASH1LRAB9A | |
| SCHEMBL19475912 | 0.83 | NPC1 (0.62) | NPC1NR4A2KIF11ASH1LRAB9A |
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-4076440-A1 | INHIBITORS OF ENL/AF9 YEATS | The Rockefeller University (US) | 2022-10-26 | — | — | EP | disclosed |