Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSP90AA1 | P07900 | 4/20 | 0.48 |
| ▸ | HSP90AB1 | P08238 | 3/20 | 0.48 |
| ▸ | PKM | P14618 | 1/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.46 |
| ▸ | TRPV1 | Q8NER1 | 3/20 | 0.45 |
| ▸ | LMNA | P02545 | 4/20 | 0.42 |
| ▸ | GAA | P10253 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | BCHE | P06276 | 1/20 | 0.40 |
| ▸ | ACHE | P22303 | 1/20 | 0.40 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.38 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.38 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.38 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.38 |
| ▸ | HTR2B | P41595 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL1245168 | 0.79 | CYP1A2 (0.57) | HSP90AA1HSP90AB1PKMCYP1A2CYP2D6 | |
| SCHEMBL11079181 | 0.75 | HSP90AA1 (0.60) | HSP90AA1HSP90AB1BCHEACHE | |
| SCHEMBL69265 | 0.73 | CYP1A2 (0.58) | PKMCYP1A2CYP2D6MAPK1TRPV1 | |
| SCHEMBL6235501 | 0.73 | TRPV1 (0.56) | HSP90AA1HSP90AB1PKMCYP1A2CYP2D6 | |
| SCHEMBL6252526 | 0.72 | CYP1A2 (0.57) | PKMCYP1A2CYP2D6MAPK1TRPV1 | |
| SCHEMBL6661840 | 0.70 | TRPV1 (0.60) | PKMCYP1A2CYP2D6MAPK1TRPV1 | |
| SCHEMBL11086375 | 0.70 | TRPV1 (0.47) | HSP90AA1HSP90AB1PKMCYP1A2CYP2D6 | |
| SCHEMBL28228079 | 0.69 | CYP1A2 (0.54) | PKMCYP1A2CYP2D6MAPK1TRPV1 | |
| SCHEMBL31545806 | 0.68 | ALOX15 (0.45) | HSP90AA1HSP90AB1PKMCYP1A2CYP2D6 | |
| SCHEMBL23484271 | 0.68 | PKM (0.50) | HSP90AA1PKMLMNAGAAMAPT |
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-4435397-A | ADRENERGIC BLOCKING AGENTS, 4-(3-ARYLOXY-2-HYDROXYPROPYL) SUBSTITUTED | NIPPON SHINYAKU CO., LTD. (JP) | 1984-03-06 | — | — | US | disclosed |