Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.46 |
| ▸ | LMNA | P02545 | 3/20 | 0.46 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.42 |
| ▸ | SRD5A2 | P31213 | 2/20 | 0.41 |
| ▸ | RAB9A | P51151 | 2/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | PDE3B | Q13370 | 2/20 | 0.39 |
| ▸ | PDE3A | Q14432 | 2/20 | 0.39 |
| ▸ | MAPT | P10636 | 3/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | MMP1 | P03956 | 1/20 | 0.38 |
| ▸ | MMP2 | P08253 | 1/20 | 0.38 |
| ▸ | MMP9 | P14780 | 1/20 | 0.38 |
| ▸ | MMP12 | P39900 | 1/20 | 0.38 |
| ▸ | CES2 | O00748 | 1/20 | 0.37 |
| ▸ | CES1 | P23141 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | COMT | P21964 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL10682419 | 0.86 | LMNA (0.39) | ALDH1A1LMNARAB9AHPGDPDE3B | |
| SCHEMBL10683064 | 0.84 | NPC1 (0.50) | ALDH1A1LMNARAB9AHPGDMAPT | |
| SCHEMBL10680196 | 0.83 | PDE3B (0.58) | LMNAPDE3BPDE3APDE4APDE4B | |
| SCHEMBL10680827 | 0.83 | RAB9A (0.35) | ALDH1A1LMNARAB9AHPGDMAPT | |
| SCHEMBL10680841 | 0.81 | MAPK1 (0.45) | ALDH1A1LMNASRD5A2MAPTL3MBTL1 | |
| SCHEMBL10377556 | 0.80 | ALDH1A1 (0.52) | ALDH1A1LMNAAKR1C3SRD5A2RAB9A | |
| SCHEMBL10677717 | 0.80 | ALDH1A1 (0.44) | ALDH1A1LMNAAKR1C3SRD5A2RAB9A | |
| SCHEMBL10675744 | 0.78 | DRD2 (0.38) | ALDH1A1HPGDPDE3BPDE3AMAPT | |
| SCHEMBL10681150 | 0.77 | UCHL1 (0.50) | ALDH1A1LMNAAKR1C3SRD5A2RAB9A | |
| SCHEMBL10681969 | 0.77 | MAPT (0.47) | ALDH1A1LMNAAKR1C3SRD5A2RAB9A |
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-4769380-A | Cardiotonic 5-benzoyl-1,2-dihydro-2-oxo-3-pyridinecarboxylates | MERRELL DOW PHARMACEUTICALS INC. (US) | 1988-09-06 | — | — | US | disclosed |