Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.44 |
| ▸ | MEN1 | O00255 | 2/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | ADH1B | P00325 | 1/20 | 0.40 |
| ▸ | ADH1C | P00326 | 1/20 | 0.40 |
| ▸ | ADH1A | P07327 | 1/20 | 0.40 |
| ▸ | ATM | Q13315 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | HTR2A | P28223 | 1/20 | 0.35 |
| ▸ | CA12 | O43570 | 2/20 | 0.35 |
| ▸ | CA1 | P00915 | 2/20 | 0.35 |
| ▸ | CA2 | P00918 | 2/20 | 0.35 |
| ▸ | MMP2 | P08253 | 2/20 | 0.35 |
| ▸ | CA9 | Q16790 | 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 | |
|---|---|---|---|---|
| SCHEMBL7560321 | 0.79 | TSHR (0.45) | TSHRMEN1KMT2AALDH1A1POLB | |
| SCHEMBL31456097 | 0.79 | TSHR (0.65) | TSHRMEN1KMT2AALDH1A1POLB | |
| SCHEMBL472875 | 0.77 | CES2 (0.39) | MEN1KMT2AALDH1A1ADH1BADH1C | |
| SCHEMBL6684532 | 0.76 | EPHX1 (0.48) | ALDH1A1MAPTCA12CA1CA2 | |
| SCHEMBL23135917 | 0.72 | TSHR (0.49) | TSHRMEN1KMT2AALDH1A1POLB | |
| Hydrochloric Acid SCHEMBL11687151 | 0.72 | ALDH1A1 (0.37) | MEN1KMT2AALDH1A1ADH1BADH1C | |
| SCHEMBL3261774 | 0.71 | NAAA (0.46) | MEN1KMT2A | |
| SCHEMBL19444815 | 0.70 | ALDH1A1 (0.48) | TSHRMEN1KMT2AALDH1A1POLB | |
| SCHEMBL13911276 | 0.70 | ADH1A (0.42) | TSHRMEN1KMT2AALDH1A1POLB | |
| SCHEMBL2275673 | 0.70 | TSHR (0.55) | TSHRMEN1KMT2AALDH1A1POLB |
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 |