Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.54 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.43 |
| ▸ | GPR84 | Q9NQS5 | 5/20 | 0.42 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.40 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.40 |
| ▸ | CA1 | P00915 | 2/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | FAAH | O00519 | 2/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | PSMD14 | O00487 | 2/20 | 0.33 |
| ▸ | PLA2G1B | P04054 | 2/20 | 0.33 |
| ▸ | MMP2 | P08253 | 2/20 | 0.33 |
| ▸ | ATG4B | Q9Y4P1 | 2/20 | 0.33 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.33 |
| ▸ | RAD52 | P43351 | 1/20 | 0.33 |
| ▸ | ACACB | O00763 | 1/20 | 0.32 |
| ▸ | ACACA | Q13085 | 1/20 | 0.32 |
| ▸ | FDPS | P14324 | 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 | |
|---|---|---|---|---|
| Nitric Acid SCHEMBL8526045 | 0.90 | ALDH1A1 (0.50) | ALDH1A1NFKB1GPR84FFAR4FFAR1 | |
| SCHEMBL8905008 | 0.90 | ALDH1A1 (0.69) | ALDH1A1NFKB1GPR84FFAR4FFAR1 | |
| SCHEMBL6382144 | 0.90 | ALDH1A1 (0.63) | ALDH1A1NFKB1GPR84FFAR4FFAR1 | |
| Nitric Acid SCHEMBL8527457 | 0.87 | ALDH1A1 (0.59) | ALDH1A1NFKB1GPR84FFAR4FFAR1 | |
| SCHEMBL6383565 | 0.86 | ALDH1A1 (0.60) | ALDH1A1NFKB1GPR84FFAR4FFAR1 | |
| SCHEMBL6383560 | 0.86 | ALDH1A1 (0.60) | ALDH1A1NFKB1GPR84FFAR4FFAR1 | |
| SCHEMBL27548544 | 0.85 | ALDH1A1 (0.46) | ALDH1A1NFKB1GPR84FFAR4FFAR1 | |
| SCHEMBL6379234 | 0.84 | ALDH1A1 (0.54) | ALDH1A1NFKB1GPR84FFAR4FFAR1 | |
| SCHEMBL8896217 | 0.84 | ALDH1A1 (0.54) | ALDH1A1NFKB1GPR84FFAR4FFAR1 | |
| Nitric Acid SCHEMBL8584091 | 0.81 | ALDH1A1 (0.50) | ALDH1A1NFKB1GPR84FFAR4FFAR1 |
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-0759917-A1 | NOVEL SELECTIVE INHIBITORS OF VIRAL OR BACTERIAL NEURAMINIDASES | GILEAD SCIENCES, INC. (US) | 1997-03-05 | — | — | EP | disclosed |