Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MMP2 | P08253 | 5/20 | 0.45 |
| ▸ | MMP9 | P14780 | 5/20 | 0.45 |
| ▸ | MMP8 | P22894 | 3/20 | 0.45 |
| ▸ | MMP12 | P39900 | 3/20 | 0.45 |
| ▸ | MMP14 | P50281 | 3/20 | 0.45 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | NOD1 | Q9Y239 | 3/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | FOLH1 | Q04609 | 3/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | FAAH | O00519 | 1/20 | 0.39 |
| ▸ | CAPN1 | P07384 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | NAALAD2 | Q9Y3Q0 | 2/20 | 0.35 |
| ▸ | RIMKLA | Q8IXN7 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL31091273 | 0.85 | MMP2 (0.49) | MMP2MMP9MMP8MMP12MMP14 | |
| SCHEMBL8517971 | 0.85 | MMP2 (0.49) | MMP2MMP9MMP8MMP12MMP14 | |
| SCHEMBL24164953 | 0.82 | MMP2 (0.47) | MMP2MMP9MMP8MMP12MMP14 | |
| SCHEMBL21297647 | 0.82 | FOLH1 (0.56) | FOLH1NAALAD2RIMKLA | |
| SCHEMBL31229271 | 0.82 | FOLH1 (0.56) | FOLH1NAALAD2RIMKLA | |
| SCHEMBL14930540 | 0.80 | CHRM1 (0.43) | MAPTCYP2D6CYP2C19FOLH1ALDH1A1 | |
| SCHEMBL29159697 | 0.79 | MMP2 (0.45) | MMP2MMP9MMP8MMP12MMP14 | |
| SCHEMBL19895221 | 0.78 | NOD1 (0.59) | MMP2MMP9MMP8MMP12MMP14 | |
| SCHEMBL31241202 | 0.78 | NOD1 (0.59) | MMP2MMP9MMP8MMP12MMP14 | |
| SCHEMBL8693439 | 0.77 | ALDH1A1 (0.50) | MMP2MMP9CYP2D6CYP2C19ALDH1A1 |
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-3057449-B1 | ORGANIC COMPOUNDS | GIVAUDAN SA (CH) | 2018-02-28 | — | — | EP | claimed |