Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | POLB | P06746 | 1/20 | 0.49 |
| ▸ | NPC1 | O15118 | 2/20 | 0.44 |
| ▸ | RAB9A | P51151 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.41 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | ITK | Q08881 | 1/20 | 0.40 |
| ▸ | PTAFR | P25105 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.40 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.40 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.39 |
| ▸ | USP2 | O75604 | 1/20 | 0.39 |
| ▸ | CNR2 | P34972 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL16365762 | 0.81 | POLB (0.52) | POLBNPC1RAB9AALDH1A1SMN1; SMN2 | |
| SCHEMBL16323722 | 0.80 | FASN (0.63) | — | |
| SCHEMBL18924451 | 0.79 | MAPK14 (0.48) | POLBNPC1RAB9AALDH1A1SMN1; SMN2 | |
| SCHEMBL18924454 | 0.78 | DYRK1A (0.49) | POLBNPC1RAB9AALDH1A1SMN1; SMN2 | |
| SCHEMBL18924557 | 0.77 | FGFR1 (0.49) | POLBNPC1RAB9AALDH1A1SMN1; SMN2 | |
| SCHEMBL18924529 | 0.75 | POLB (0.46) | POLBNPC1RAB9AALDH1A1SMN1; SMN2 | |
| SCHEMBL18924392 | 0.74 | MAPK14 (0.44) | POLBNPC1RAB9AALDH1A1SMN1; SMN2 | |
| SCHEMBL18924383 | 0.74 | ALDH1A1 (0.53) | POLBNPC1RAB9AALDH1A1SMN1; SMN2 | |
| SCHEMBL18924388 | 0.73 | POLB (0.50) | POLBNPC1RAB9AALDH1A1SMN1; SMN2 | |
| SCHEMBL9001766 | 0.73 | ALDH1A1 (0.66) | POLBNPC1RAB9AALDH1A1SMN1; SMN2 |
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-3010916-B1 | 1,3-DIAMINOCYCLOPENTANE CARBOXAMIDE DERIVATIVES | MERCK PATENT GMBH (DE) | 2017-09-27 | — | — | EP | disclosed |
| US-9670142-B2 | 1,3-diaminocyclopentane carboxamide derivatives | MERCK PATENT GMBH (DE) | 2017-06-06 | — | — | US | disclosed |