Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGDS | O60760 | 1/20 | 0.51 |
| ▸ | ALKBH2 | Q6NS38 | 1/20 | 0.51 |
| ▸ | BTK | Q06187 | 1/20 | 0.47 |
| ▸ | NPC1 | O15118 | 5/20 | 0.46 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.45 |
| ▸ | MLLT3 | P42568 | 1/20 | 0.44 |
| ▸ | MLLT1 | Q03111 | 1/20 | 0.44 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.44 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 5/20 | 0.43 |
| ▸ | MAPT | P10636 | 4/20 | 0.43 |
| ▸ | HPGD | P15428 | 2/20 | 0.43 |
| ▸ | HTT | P42858 | 2/20 | 0.43 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.43 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.43 |
| ▸ | RELA | Q04206 | 1/20 | 0.43 |
| ▸ | MAPKAPK2 | P49137 | 1/20 | 0.42 |
| ▸ | PARP1 | P09874 | 1/20 | 0.41 |
| ▸ | PARP15 | Q460N3 | 1/20 | 0.41 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL4481678 | 1.00 | HPGDS (0.51) | HPGDSALKBH2BTKNPC1MAP4K4 | |
| SCHEMBL3374557 | 0.88 | ALKBH2 (0.69) | HPGDSALKBH2NPC1MLLT3MLLT1 | |
| SCHEMBL5063087 | 0.87 | HPGDS (0.50) | HPGDSALKBH2BTKNPC1MAP4K4 | |
| SCHEMBL2190049 | 0.82 | ALKBH2 (0.74) | HPGDSALKBH2NPC1MAP4K4RAB9A | |
| SCHEMBL10139147 | 0.81 | MAP4K4 (0.56) | HPGDSALKBH2BTKNPC1MAP4K4 | |
| SCHEMBL3107063 | 0.80 | EPHX2 (0.64) | HPGDSALKBH2BTKNPC1RAB9A | |
| SCHEMBL30978305 | 0.78 | BTK (0.48) | HPGDSALKBH2BTKNPC1RAB9A | |
| SCHEMBL23846557 | 0.77 | F7 (0.54) | HPGDSALKBH2BTKNPC1MAP4K4 | |
| SCHEMBL4500055 | 0.76 | SCN9A (0.54) | HPGDSALKBH2BTKNPC1MAP4K4 | |
| Isophthalic Acid SCHEMBL27862943 | 0.74 | ALKBH2 (0.54) | HPGDSALKBH2NPC1KEAP1NFE2L2 |
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-4100015-A1 | COMBINATION THERAPY FOR TREATING MPS1 | Gain Therapeutics SA (CH) | 2022-12-14 | — | — | EP | disclosed |