Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK14 | Q16539 | 1/20 | 0.51 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | TRPV3 | Q8NET8 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | GHSR | Q92847 | 2/20 | 0.39 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.39 |
| ▸ | FASN | P49327 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | WDR5 | P61964 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 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 | |
|---|---|---|---|---|
| SCHEMBL18924461 | 0.85 | MAPK14 (0.47) | MAPK14POLBNPC1RAB9ATRPV3 | |
| SCHEMBL19391173 | 0.85 | FASN (0.48) | MAPK14POLBNPC1RAB9ATRPV3 | |
| SCHEMBL18924529 | 0.84 | POLB (0.46) | MAPK14POLBNPC1RAB9AALDH1A1 | |
| SCHEMBL16323115 | 0.81 | FASN (0.63) | FASN | |
| SCHEMBL18924432 | 0.80 | FASN (0.53) | MAPK14POLBNPC1RAB9AALDH1A1 | |
| SCHEMBL2926458 | 0.80 | POLB (0.55) | MAPK14POLBNPC1RAB9AALDH1A1 | |
| SCHEMBL10762514 | 0.80 | RAB9A (0.52) | POLBNPC1RAB9AALDH1A1GAA | |
| SCHEMBL18924540 | 0.79 | MAPK14 (0.47) | MAPK14POLBNPC1RAB9AALDH1A1 | |
| SCHEMBL18924450 | 0.79 | MAPK14 (0.58) | MAPK14POLBNPC1RAB9AALDH1A1 | |
| SCHEMBL20897035 | 0.79 | RAB9A (0.54) | POLBNPC1RAB9AALDH1A1GAA |
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 |