Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 6/20 | 0.58 |
| ▸ | GAA | P10253 | 1/20 | 0.58 |
| ▸ | NPC1 | O15118 | 5/20 | 0.54 |
| ▸ | CLK1 | P49759 | 1/20 | 0.54 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.53 |
| ▸ | MAPT | P10636 | 3/20 | 0.52 |
| ▸ | POLB | P06746 | 1/20 | 0.52 |
| ▸ | PKM | P14618 | 1/20 | 0.52 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.52 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.50 |
| ▸ | MEN1 | O00255 | 1/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.50 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.45 |
| ▸ | MMP1 | P03956 | 1/20 | 0.44 |
| ▸ | MMP13 | P45452 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL27107843 | 0.89 | RAB9A (0.67) | RAB9AGAANPC1CLK1L3MBTL1 | |
| SCHEMBL27113213 | 0.88 | RAB9A (0.58) | RAB9AGAANPC1CLK1L3MBTL1 | |
| Bromide SCHEMBL27139844 | 0.88 | RAB9A (0.66) | RAB9AGAANPC1CLK1L3MBTL1 | |
| SCHEMBL12875862 | 0.85 | RAB9A (0.59) | RAB9AGAANPC1CLK1L3MBTL1 | |
| SCHEMBL2080725 | 0.85 | RAB9A (0.68) | RAB9AGAANPC1CLK1L3MBTL1 | |
| SCHEMBL14564380 | 0.84 | RAB9A (0.58) | RAB9AGAANPC1CLK1L3MBTL1 | |
| SCHEMBL2328911 | 0.83 | L3MBTL1 (0.74) | RAB9AGAANPC1CLK1L3MBTL1 | |
| SCHEMBL4726197 | 0.83 | RAB9A (0.60) | RAB9AGAANPC1CLK1L3MBTL1 | |
| SCHEMBL30807340 | 0.82 | RAB9A (0.52) | RAB9AGAANPC1CLK1L3MBTL1 | |
| SCHEMBL27109310 | 0.82 | RAB9A (0.52) | RAB9AGAANPC1CLK1L3MBTL1 |
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-3016951-B1 | TRICYCLIC PYRIDO-CARBOXAMIDE DERIVATIVES AS ROCK INHIBITORS | BRISTOL MYERS SQUIBB CO (US) | 2017-05-31 | — | — | EP | disclosed |