Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 5/20 | 0.53 |
| ▸ | RAB9A | P51151 | 5/20 | 0.53 |
| ▸ | NPC1 | O15118 | 3/20 | 0.53 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.49 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.49 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.49 |
| ▸ | HDAC6 | Q9UBN7 | 3/20 | 0.48 |
| ▸ | MEN1 | O00255 | 2/20 | 0.46 |
| ▸ | POLB | P06746 | 2/20 | 0.46 |
| ▸ | GAA | P10253 | 2/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | PKM | P14618 | 1/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL25787474 | 0.90 | HSD17B10 (0.45) | MAPTRAB9ANPC1ROCK1KMT2A | |
| SCHEMBL13436713 | 0.81 | RAB9A (0.66) | MAPTRAB9ANPC1ROCK1KMT2A | |
| SCHEMBL3956383 | 0.81 | RAB9A (0.57) | MAPTRAB9ANPC1ROCK1KMT2A | |
| SCHEMBL25787489 | 0.75 | HDAC6 (0.48) | MAPTRAB9ANPC1ROCK1KMT2A | |
| SCHEMBL18235580 | 0.74 | NPC1 (0.69) | MAPTRAB9ANPC1KMT2AMEN1 | |
| SCHEMBL23175289 | 0.74 | MAPT (0.60) | MAPTRAB9ANPC1ROCK1KMT2A | |
| SCHEMBL23204600 | 0.74 | MAPT (0.58) | MAPTRAB9ANPC1ROCK1KMT2A | |
| SCHEMBL14867035 | 0.73 | MAPT (0.61) | MAPTRAB9ANPC1ROCK1KMT2A | |
| SCHEMBL1748093 | 0.73 | MAPT (0.61) | MAPTRAB9ANPC1ROCK1KMT2A | |
| SCHEMBL33525283 | 0.73 | IL6 (0.65) | MAPTRAB9ANPC1ROCK1KMT2A |
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-2023121022-A1 | NOVEL LEUKOTRIENE B4 RECEPTOR INHIBITORS AND USE THEREOF | 이화여자대학교 산학협력단 | 2023-06-29 | — | — | WO | disclosed |