Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PKM | P14618 | 1/20 | 0.54 |
| ▸ | MEN1 | O00255 | 3/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.47 |
| ▸ | NPC1 | O15118 | 2/20 | 0.47 |
| ▸ | NHERF1 | O14745 | 1/20 | 0.46 |
| ▸ | CFTR | P13569 | 3/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.44 |
| ▸ | MAPT | P10636 | 2/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | ITGB1 | P05556 | 1/20 | 0.42 |
| ▸ | ITGA4 | P13612 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL71626 | 0.91 | PKM (0.57) | PKMMEN1KMT2ANPC1NHERF1 | |
| SCHEMBL73753 | 0.86 | NHERF1 (0.51) | MEN1KMT2ANPC1NHERF1CFTR | |
| SCHEMBL2438042 | 0.83 | ITGB1 (0.53) | PKMMEN1KMT2ANPC1NHERF1 | |
| SCHEMBL5708329 | 0.82 | PKM (0.40) | PKMKMT2ANHERF1ALDH1A1KDM4E | |
| SCHEMBL14592698 | 0.82 | ITGB1 (0.56) | PKMKMT2ANPC1SMN1; SMN2ITGB1 | |
| SCHEMBL92571 | 0.82 | NPC1 (0.57) | MEN1KMT2ANPC1NHERF1CFTR | |
| SCHEMBL72819 | 0.81 | MAOB (0.45) | NPC1MAPTSMN1; SMN2ITGB1ITGA4 | |
| SCHEMBL72217 | 0.81 | MAPT (0.41) | MEN1KMT2ANPC1CYP1A2CYP3A4 | |
| SCHEMBL14491705 | 0.77 | ITGB1 (0.55) | MEN1KMT2ANPC1TDP1MAPT | |
| SCHEMBL14592356 | 0.77 | SMN1; SMN2 (0.44) | MEN1KMT2ANPC1CYP1A2SMN1; SMN2 |
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-1961750-B1 | VLA-4 INHIBITORY DRUG | DAIICHI SANKYO CO LTD (JP) | 2013-09-18 | — | — | EP | disclosed |