Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK1 | P28482 | 1/20 | 0.69 |
| ▸ | HPGD | P15428 | 4/20 | 0.60 |
| ▸ | SLC9A1 | P19634 | 1/20 | 0.59 |
| ▸ | SLC9A2 | Q9UBY0 | 1/20 | 0.59 |
| ▸ | NPC1 | O15118 | 11/20 | 0.59 |
| ▸ | RAB9A | P51151 | 11/20 | 0.59 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.59 |
| ▸ | NFKB2 | Q00653 | 2/20 | 0.59 |
| ▸ | RELA | Q04206 | 2/20 | 0.59 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.59 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.58 |
| ▸ | NR4A3 | Q92570 | 1/20 | 0.57 |
| ▸ | PKM | P14618 | 2/20 | 0.57 |
| ▸ | MAPT | P10636 | 2/20 | 0.56 |
| ▸ | POLB | P06746 | 1/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.55 |
| ▸ | MEN1 | O00255 | 1/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.53 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL1778201 | 0.86 | MAPK1 (0.68) | MAPK1HPGDSLC9A1SLC9A2NPC1 | |
| SCHEMBL13506217 | 0.85 | MAPK1 (0.50) | MAPK1HPGDSLC9A1SLC9A2NPC1 | |
| SCHEMBL18933496 | 0.84 | HTT (0.59) | MAPK1HPGDNPC1RAB9ANFKB1 | |
| SCHEMBL27405 | 0.83 | MAPK1 (0.78) | MAPK1HPGDSLC9A1SLC9A2NPC1 | |
| SCHEMBL20250838 | 0.83 | NR4A3 (0.56) | MAPK1HPGDNPC1RAB9ANFKB1 | |
| SCHEMBL13848993 | 0.83 | NR4A3 (0.78) | MAPK1HPGDNPC1RAB9ANFKB1 | |
| SCHEMBL2544046 | 0.82 | MAPK1 (1.00) | MAPK1HPGDSLC9A1SLC9A2NPC1 | |
| SCHEMBL1065124 | 0.82 | ALDH1A1 (0.75) | MAPK1HPGDSLC9A1SLC9A2NPC1 | |
| SCHEMBL19997263 | 0.82 | MAPK14 (0.52) | MAPK1HPGDSLC9A1SLC9A2NPC1 | |
| SCHEMBL2926133 | 0.81 | MAPK1 (0.73) | MAPK1HPGDSLC9A1SLC9A2NPC1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-9926282-B2 | Phthalazinones and isoquinolinones as rock inhibitors | BRISTOL-MYERS SQUIBB COMPANY (US) | 2018-03-27 | — | — | US | disclosed |
| US-9902702-B2 | Spirocycloheptanes as inhibitors of rock | BRISTOL-MYERS SQUIBB COMPANY (US) | 2018-02-27 | — | — | US | disclosed |