Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.49 |
| ▸ | LMNA | P02545 | 3/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.46 |
| ▸ | GAA | P10253 | 2/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | PARP1 | P09874 | 2/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.39 |
| ▸ | MYC | P01106 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL11173849 | 0.84 | MYC (0.51) | ALDH1A1LMNAL3MBTL1CYP2C19CYP2C9 | |
| SCHEMBL5319528 | 0.81 | IDO1 (0.47) | ALDH1A1LMNAGAACYP2C19CYP2C9 | |
| SCHEMBL607557 | 0.81 | ALDH1A1 (0.65) | ALDH1A1LMNAL3MBTL1GAACYP2C19 | |
| SCHEMBL5789460 | 0.79 | ALDH1A1 (0.49) | ALDH1A1LMNAL3MBTL1GAACYP2C19 | |
| SCHEMBL5785069 | 0.78 | ALDH1A1 (0.49) | ALDH1A1LMNAL3MBTL1GAACYP2C19 | |
| SCHEMBL39964 | 0.78 | KDM4E (0.52) | ALDH1A1GAAPARP1KDM4EMAPT | |
| Hydrochloric Acid SCHEMBL4562961 | 0.76 | PARP1 (0.50) | ALDH1A1GAAPARP1KDM4EMAPT | |
| SCHEMBL28793930 | 0.76 | NPC1 (0.63) | ALDH1A1LMNAL3MBTL1GAANPC1 | |
| SCHEMBL27765492 | 0.76 | NPC1 (0.44) | ALDH1A1LMNAGAANPC1PARP1 | |
| SCHEMBL3684197 | 0.75 | ALDH1A1 (0.45) | ALDH1A1LMNAL3MBTL1GAANPC1 |
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-2691375-A1 | SUBSTITUTED BENZIMIDAZOLES | Bayer Intellectual Property GmbH (DE) | 2014-02-05 | — | — | EP | claimed |
| WO-2012130905-A1 | SUBSTITUTED BENZIMIDAZOLES | BAYER PHARMA AKTIENGESELLSCHAFT (DE) | 2012-10-04 | — | — | WO | claimed |