Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MTNR1A | P48039 | 1/20 | 0.60 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.60 |
| ▸ | HTT | P42858 | 4/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.47 |
| ▸ | HPGD | P15428 | 2/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.47 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.47 |
| ▸ | NCOA1 | Q15788 | 1/20 | 0.47 |
| ▸ | NCOA3 | Q9Y6Q9 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 6/20 | 0.46 |
| ▸ | MAPT | P10636 | 6/20 | 0.45 |
| ▸ | LMNA | P02545 | 5/20 | 0.45 |
| ▸ | MEN1 | O00255 | 3/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.45 |
| ▸ | TP53 | P04637 | 1/20 | 0.45 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | CDYL2 | Q8N8U2 | 1/20 | 0.42 |
| ▸ | CDYL | Q9Y232 | 1/20 | 0.42 |
| ▸ | CDY1; CDY1B | Q9Y6F8 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL12479232 | 0.89 | MTNR1A (0.66) | MTNR1AMTNR1BHTTALDH1A1HPGD | |
| SCHEMBL9040429 | 0.85 | MTNR1A (0.61) | MTNR1AMTNR1BHTTALDH1A1HPGD | |
| SCHEMBL19911358 | 0.85 | MTNR1A (0.61) | MTNR1AMTNR1BHTTALDH1A1HPGD | |
| SCHEMBL19312319 | 0.84 | MTNR1A (0.55) | MTNR1AMTNR1BHTTALDH1A1HPGD | |
| SCHEMBL27038883 | 0.82 | MTNR1A (0.65) | MTNR1AMTNR1BHTTALDH1A1HPGD | |
| SCHEMBL19911346 | 0.81 | MTNR1A (0.64) | MTNR1AMTNR1BHTTALDH1A1HPGD | |
| SCHEMBL16407632 | 0.81 | MTNR1A (0.55) | MTNR1AMTNR1BHTTALDH1A1HPGD | |
| SCHEMBL19611398 | 0.80 | MTNR1A (0.62) | MTNR1AMTNR1BHTTALDH1A1HPGD | |
| SCHEMBL12479984 | 0.80 | MTNR1A (0.62) | MTNR1AMTNR1BHTTALDH1A1HPGD | |
| SCHEMBL9120412 | 0.80 | MTNR1A (0.62) | MTNR1AMTNR1BHTTALDH1A1HPGD |
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-3022198-B1 | NOVEL 5-SUBSTITUTED BENZIMIDAZOLIUM COMPOUNDS | BOEHRINGER INGELHEIM INT (DE) | 2019-09-11 | — | — | EP | disclosed |
| WO-2015007516-A1 | NOVEL 5-SUBSTITUTED BENZIMIDAZOLIUM COMPOUNDS | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2015-01-22 | — | — | WO | disclosed |