Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DCTPP1 | Q9H773 | 1/20 | 0.44 |
| ▸ | HCAR3 | P49019 | 3/20 | 0.40 |
| ▸ | MAPT | P10636 | 4/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 2/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | CNR1 | P21554 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | MELK | Q14680 | 1/20 | 0.35 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL572591 | 0.88 | CNR1 (0.42) | DCTPP1MAPTMAPK1LMNAHTT | |
| SCHEMBL572590 | 0.88 | CNR1 (0.42) | DCTPP1MAPTMAPK1LMNAHTT | |
| SCHEMBL573176 | 0.83 | DCTPP1 (0.40) | DCTPP1HCAR3MAPTMAPK1LMNA | |
| SCHEMBL573175 | 0.83 | DCTPP1 (0.40) | DCTPP1HCAR3MAPTMAPK1LMNA | |
| SCHEMBL573174 | 0.83 | DCTPP1 (0.40) | DCTPP1HCAR3MAPTMAPK1LMNA | |
| SCHEMBL572153 | 0.81 | HCAR3 (0.48) | DCTPP1HCAR3MAPTMAPK1HTT | |
| SCHEMBL572154 | 0.81 | HCAR3 (0.48) | DCTPP1HCAR3MAPTMAPK1HTT | |
| SCHEMBL572975 | 0.81 | HCAR3 (0.48) | DCTPP1HCAR3MAPTMAPK1HTT | |
| SCHEMBL30726366 | 0.80 | MEN1 (0.49) | DCTPP1HCAR3MAPTMAPK1LMNA | |
| SCHEMBL15174387 | 0.80 | MEN1 (0.49) | DCTPP1HCAR3MAPTMAPK1LMNA |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2611784-A1 | BENZIMIDAZOLE AND AZABENZIMIDAZOLE COMPOUNDS THAT INHIBIT ANAPLASTIC LYMPHOMA KINASE | Amgen, Inc (US) | 2013-07-10 | — | — | EP | disclosed |
| WO-2012018668-A1 | BENZIMIDAZOLE AND AZABENZIMIDAZOLE COMPOUNDS THAT INHIBIT ANAPLASTIC LYMPHOMA KINASE | AMGEN INC. (US) | 2012-02-09 | — | — | WO | disclosed |