Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOB | P27338 | 10/20 | 0.46 |
| ▸ | MAOA | P21397 | 8/20 | 0.46 |
| ▸ | CDK1 | P06493 | 4/20 | 0.44 |
| ▸ | MAPKAPK2 | P49137 | 4/20 | 0.44 |
| ▸ | GRM5 | P41594 | 2/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.42 |
| ▸ | RELA | Q04206 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.42 |
| ▸ | EDNRA | P25101 | 1/20 | 0.42 |
| ▸ | PRKD1 | Q15139 | 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 | |
|---|---|---|---|---|
| SCHEMBL19696372 | 0.94 | MAOB (0.45) | MAOBMAOACDK1MAPKAPK2GRM5 | |
| SCHEMBL15474147 | 0.83 | MAPKAPK2 (0.47) | CDK1MAPKAPK2PRKD1 | |
| SCHEMBL19696358 | 0.82 | CDK1 (0.65) | MAOBMAOACDK1MAPKAPK2EDNRA | |
| SCHEMBL6649916 | 0.81 | MAPKAPK2 (0.65) | CDK1MAPKAPK2NPC1ALDH1A1HPGD | |
| SCHEMBL9903995 | 0.80 | PRKD1 (0.67) | MAOBMAOACDK1MAPKAPK2EDNRA | |
| SCHEMBL19696371 | 0.78 | PRKD1 (0.68) | MAOBMAOACDK1MAPKAPK2EDNRA | |
| SCHEMBL9920608 | 0.77 | MAPKAPK2 (0.48) | CDK1MAPKAPK2ALDH1A1HPGDPRKD1 | |
| SCHEMBL15472006 | 0.74 | CDK1 (0.43) | CDK1MAPKAPK2ALDH1A1PRKD1 | |
| SCHEMBL2983060 | 0.74 | MAOB (0.67) | MAOBMAOAGRM5NPC1ALDH1A1 | |
| SCHEMBL3156910 | 0.72 | ALOX5 (0.58) | MAOBMAOARAB9ASMN1; SMN2EDNRA |
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-9840515-B2 | Protein kinase D inhibitors | University of Pittsburgh—of the Commonwealth System of Higher Education (US) | 2017-12-12 | — | — | US | disclosed |