Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNA7 | P36544 | 2/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | PKM | P14618 | 1/20 | 0.38 |
| ▸ | CA12 | O43570 | 3/20 | 0.37 |
| ▸ | CA1 | P00915 | 3/20 | 0.37 |
| ▸ | CA2 | P00918 | 3/20 | 0.37 |
| ▸ | CA7 | P43166 | 3/20 | 0.37 |
| ▸ | CA9 | Q16790 | 3/20 | 0.37 |
| ▸ | CA14 | Q9ULX7 | 3/20 | 0.37 |
| ▸ | KCNK3 | O14649 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | ESR1 | P03372 | 2/20 | 0.35 |
| ▸ | NPC1 | O15118 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | TP53 | P04637 | 2/20 | 0.35 |
| ▸ | RAB9A | P51151 | 2/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL18932931 | 0.91 | CA12 (0.43) | CHRNA7MAPTCA12CA1CA2 | |
| SCHEMBL14813035 | 0.88 | KCNK3 (0.48) | MAPTKCNK3ALDH1A1KDM4EHSD17B2 | |
| SCHEMBL18932675 | 0.85 | KCNK3 (0.48) | MAPTCA12CA1CA2CA7 | |
| SCHEMBL14811913 | 0.83 | KCNK3 (0.48) | MAPTCA12CA1CA2CA7 | |
| SCHEMBL18932695 | 0.83 | KCNK3 (0.39) | CHRNA7MAPTCA12CA1CA2 | |
| SCHEMBL8486452 | 0.81 | KCNK3 (0.57) | MAPTKCNK3CYP2C19NPSR1ALDH1A1 | |
| SCHEMBL14812701 | 0.79 | KCNK3 (0.48) | MAPTKCNK3CYP2C19NPSR1ALDH1A1 | |
| SCHEMBL14812728 | 0.79 | KCNK3 (0.43) | MAPTCA12CA1CA2CA7 | |
| SCHEMBL21473826 | 0.76 | KCNK3 (0.42) | MAPTCA12CA1CA2CA7 | |
| SCHEMBL14813041 | 0.75 | KCNK3 (0.45) | MAPTKCNK3CYP2C19NPSR1ALDH1A1 |
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-2763986-B1 | FSH RECEPTOR ANTAGONISTS | MERCK SHARP & DOHME (NL) | 2017-06-07 | — | — | EP | disclosed |