Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.67 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.67 |
| ▸ | HIF1A | Q16665 | 3/20 | 0.67 |
| ▸ | LMNA | P02545 | 3/20 | 0.67 |
| ▸ | MAPT | P10636 | 2/20 | 0.67 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.67 |
| ▸ | THPO | P40225 | 2/20 | 0.67 |
| ▸ | PMP22 | Q01453 | 2/20 | 0.67 |
| ▸ | GMNN | O75496 | 1/20 | 0.67 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.67 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.67 |
| ▸ | TSHR | P16473 | 1/20 | 0.67 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.67 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.67 |
| ▸ | SLCO1B3 | Q9NPD5 | 1/20 | 0.67 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.61 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.53 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.53 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL7470724 | 0.90 | ALDH1A1 (0.77) | ALDH1A1SMN1; SMN2HIF1ALMNAMAPT | |
| SCHEMBL28693401 | 0.87 | ALDH1A1 (0.68) | ALDH1A1SMN1; SMN2HIF1ALMNAMAPT | |
| SCHEMBL2564390 | 0.86 | ALDH1A1 (0.82) | ALDH1A1SMN1; SMN2HIF1ALMNAMAPT | |
| SCHEMBL14839591 | 0.85 | ALDH1A1 (0.65) | ALDH1A1SMN1; SMN2HIF1ALMNAMAPT | |
| SCHEMBL7472387 | 0.82 | ALDH1A1 (0.57) | ALDH1A1SMN1; SMN2HIF1ALMNAMAPT | |
| SCHEMBL7466474 | 0.81 | LMNA (0.60) | ALDH1A1SMN1; SMN2HIF1ALMNAMAPT | |
| Chlorambucil SCHEMBL17803671 | 0.81 | SMN1; SMN2 (0.94) | ALDH1A1SMN1; SMN2HIF1ALMNAMAPT | |
| SCHEMBL11516322 | 0.80 | ALDH1A1 (0.77) | ALDH1A1SMN1; SMN2HIF1ALMNAMAPT | |
| SCHEMBL2113384 | 0.80 | ALDH1A1 (0.77) | ALDH1A1SMN1; SMN2HIF1ALMNAMAPT | |
| Chlorambucil SCHEMBL5318105 | 0.80 | SMN1; SMN2 (1.00) | ALDH1A1SMN1; SMN2HIF1ALMNAMAPT |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0711768-B1 | BENZIMIDAZOLE DERIVATIVE | MITSUI CHEMICALS INC (JP) | 2002-02-13 | — | — | EP | disclosed |
| US-5852011-A | Benzimidazole derivatives | MITSUI CHEMICALS, INC. (JP) | 1998-12-22 | — | — | US | disclosed |
| EP-0711768-A1 | BENZIMIDAZOLE DERIVATIVE | MITSUI TOATSU CHEMICALS, Inc. (JP) | 1996-05-15 | — | — | EP | disclosed |