Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PYCR1 | P32322 | 1/20 | 0.46 |
| ▸ | KDM1A | O60341 | 3/20 | 0.38 |
| ▸ | AKR1B1 | P15121 | 2/20 | 0.37 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.37 |
| ▸ | NAAA | Q02083 | 1/20 | 0.36 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.36 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.35 |
| ▸ | P2RX7 | Q99572 | 2/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | KDM1B | Q8NB78 | 1/20 | 0.34 |
| ▸ | HSP90B1 | P14625 | 1/20 | 0.34 |
| ▸ | TRAP1 | Q12931 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL1310479 | 0.77 | PYCR1 (0.50) | PYCR1KDM1AAKR1B1PDPK1NAAA | |
| Hydrochloric Acid SCHEMBL27635784 | 0.75 | PYCR1 (0.49) | PYCR1KDM1AAKR1B1PDPK1NAAA | |
| SCHEMBL15806743 | 0.74 | PYCR1 (0.47) | PYCR1KDM1AAKR1B1PDPK1NAAA | |
| SCHEMBL20465750 | 0.74 | PYCR1 (0.47) | PYCR1KDM1AAKR1B1PDPK1NAAA | |
| SCHEMBL31448605 | 0.74 | PYCR1 (0.47) | PYCR1KDM1AAKR1B1PDPK1NAAA | |
| SCHEMBL308050 | 0.74 | PYCR1 (0.47) | PYCR1KDM1AAKR1B1PDPK1NAAA | |
| SCHEMBL29393338 | 0.74 | PYCR1 (0.47) | PYCR1KDM1AAKR1B1PDPK1NAAA | |
| SCHEMBL5404668 | 0.73 | PYCR1 (0.47) | PYCR1KDM1AAKR1B1PDPK1NAAA | |
| Hydrochloric Acid SCHEMBL28760014 | 0.73 | PYCR1 (0.47) | PYCR1KDM1AAKR1B1PDPK1NAAA | |
| SCHEMBL2095254 | 0.72 | PYCR1 (0.46) | PYCR1KDM1AAKR1B1PDPK1NAAA |
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 |
|---|---|---|---|---|---|---|---|
| WO-2004020441-A1 | HETEREOARYL NITRILE DERIVATIVES | NOVARTIS AG (CH) | 2004-03-11 | — | — | WO | disclosed |