Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSP90AA1 | P07900 | 2/20 | 0.47 |
| ▸ | HSP90AB1 | P08238 | 2/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | SCN10A | Q9Y5Y9 | 3/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 3/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.38 |
| ▸ | NUDT1 | P36639 | 1/20 | 0.38 |
| ▸ | KDM1A | O60341 | 1/20 | 0.38 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.37 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.37 |
| ▸ | ENPP3 | O14638 | 1/20 | 0.36 |
| ▸ | ENPP1 | P22413 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 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 | |
|---|---|---|---|---|
| SCHEMBL3717610 | 0.82 | HSP90AA1 (0.40) | HSP90AA1HSP90AB1CYP3A4SCN10AMEN1 | |
| SCHEMBL30485666 | 0.79 | CD274 (0.46) | CYP3A4ALDH1A1SMN1; SMN2MEN1KMT2A | |
| SCHEMBL19785375 | 0.78 | HSP90AA1 (0.56) | HSP90AA1HSP90AB1CYP3A4ALDH1A1SCN10A | |
| SCHEMBL15751000 | 0.78 | HSP90AA1 (0.51) | HSP90AA1HSP90AB1CYP3A4ALDH1A1SCN10A | |
| SCHEMBL3717873 | 0.75 | MEN1 (0.36) | HSP90AA1HSP90AB1CYP3A4ALDH1A1SCN10A | |
| SCHEMBL31448463 | 0.75 | DPP4 (0.44) | HSP90AA1HSP90AB1ALDH1A1SMN1; SMN2KMT2A | |
| SCHEMBL31449884 | 0.74 | MEN1 (0.47) | HSP90AA1HSP90AB1CYP3A4ALDH1A1MEN1 | |
| SCHEMBL29092217 | 0.73 | HSP90AA1 (0.50) | HSP90AA1HSP90AB1SCN10AKDM1ACCNE1 | |
| SCHEMBL22949436 | 0.72 | GPR3 (0.46) | CYP3A4ALDH1A1MEN1KMT2AALOX15 | |
| SCHEMBL322093 | 0.72 | CA12 (0.46) | HSP90AA1HSP90AB1ALDH1A1MEN1KMT2A |
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-2010136778-A1 | DIBENZOTHIOPHENE DERIVATIVES AS DNA- PK INHIBITORS | KUDOS PHARMACEUTICALS LIMITED (GB) | 2010-12-02 | — | — | WO | disclosed |