Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK14 | Q16539 | 1/20 | 0.55 |
| ▸ | CNR2 | P34972 | 1/20 | 0.50 |
| ▸ | POLB | P06746 | 1/20 | 0.48 |
| ▸ | NPC1 | O15118 | 1/20 | 0.48 |
| ▸ | RAB9A | P51151 | 1/20 | 0.48 |
| ▸ | FASN | P49327 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | ERN1 | O75460 | 1/20 | 0.46 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | MCHR1 | Q99705 | 2/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.43 |
| ▸ | HTR2C | P28335 | 1/20 | 0.43 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.42 |
| ▸ | USP30 | Q70CQ3 | 1/20 | 0.41 |
| ▸ | PTAFR | P25105 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL24746299 | 0.88 | CNR2 (0.59) | MAPK14CNR2POLBNPC1RAB9A | |
| SCHEMBL18924525 | 0.83 | KCNH2 (0.57) | MAPK14POLBNPC1RAB9AALDH1A1 | |
| SCHEMBL18924335 | 0.83 | MAPK14 (0.52) | MAPK14CNR2POLBNPC1RAB9A | |
| SCHEMBL19391338 | 0.82 | FASN (0.64) | MAPK14CNR2POLBNPC1RAB9A | |
| SCHEMBL18924386 | 0.82 | MAPK14 (0.51) | MAPK14POLBNPC1RAB9AFASN | |
| SCHEMBL18924523 | 0.82 | RXRB (0.50) | MAPK14CNR2POLBNPC1RAB9A | |
| SCHEMBL18924347 | 0.81 | MAPK14 (0.48) | MAPK14POLBNPC1RAB9AFASN | |
| SCHEMBL18924450 | 0.79 | MAPK14 (0.58) | MAPK14CNR2POLBNPC1RAB9A | |
| SCHEMBL16323182 | 0.79 | FASN (0.77) | FASN | |
| SCHEMBL16365760 | 0.79 | FASN (0.77) | FASN |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-9670142-B2 | 1,3-diaminocyclopentane carboxamide derivatives | MERCK PATENT GMBH (DE) | 2017-06-06 | — | — | US | disclosed |