Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PKM | P14618 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 7/20 | 0.45 |
| ▸ | MEN1 | O00255 | 6/20 | 0.45 |
| ▸ | NPC1 | O15118 | 3/20 | 0.44 |
| ▸ | RAB9A | P51151 | 3/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | CTSL | P07711 | 1/20 | 0.43 |
| ▸ | CTSK | P43235 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 2/20 | 0.43 |
| ▸ | DDX3X | O00571 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.43 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.42 |
| ▸ | CCR2 | P41597 | 1/20 | 0.42 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL8397659 | 0.79 | NPC1 (0.56) | PKMKMT2AMEN1NPC1RAB9A | |
| SCHEMBL30321478 | 0.79 | NPC1 (0.56) | PKMKMT2AMEN1NPC1RAB9A | |
| SCHEMBL27965185 | 0.79 | CTSL (0.47) | ALDH1A1CTSLCTSKPOLBROCK2 | |
| SCHEMBL1197657 | 0.79 | PKM (0.68) | PKMKMT2AMEN1NPC1RAB9A | |
| SCHEMBL3575546 | 0.79 | KMT2A (0.52) | PKMKMT2AMEN1NPC1RAB9A | |
| SCHEMBL3575542 | 0.79 | KMT2A (0.52) | PKMKMT2AMEN1NPC1RAB9A | |
| SCHEMBL3575545 | 0.79 | KMT2A (0.52) | PKMKMT2AMEN1NPC1RAB9A | |
| SCHEMBL30780915 | 0.77 | MAPT (0.61) | KMT2AMEN1NPC1RAB9AALDH1A1 | |
| SCHEMBL21959807 | 0.76 | IDH2 (0.47) | KMT2AMEN1CTSLCTSK | |
| SCHEMBL3475933 | 0.76 | NPC1 (0.67) | KMT2AMEN1NPC1RAB9AALDH1A1 |
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-2840080-B1 | NITROGEN-CONTAINING HETEROCYCLIC COMPOUND OR SALT THEREOF | FUJIFILM CORP (JP) | 2017-12-06 | — | — | EP | disclosed |