Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 2/20 | 0.41 |
| ▸ | HSP90AA1 | P07900 | 3/20 | 0.37 |
| ▸ | KDM1A | O60341 | 2/20 | 0.33 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.33 |
| ▸ | IDO1 | P14902 | 3/20 | 0.33 |
| ▸ | GPR35 | Q9HC97 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.32 |
| ▸ | NPC1 | O15118 | 2/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.32 |
| ▸ | RAB9A | P51151 | 2/20 | 0.32 |
| ▸ | TP53 | P04637 | 2/20 | 0.32 |
| ▸ | TSHR | P16473 | 2/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | CASP1 | P29466 | 2/20 | 0.32 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 3/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.31 |
| ▸ | HTT | P42858 | 3/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL8062626 | 0.83 | EGFR (0.41) | EGFRHSP90AA1KDM1AGPR35ALDH1A1 | |
| SCHEMBL7086205 | 0.81 | KDM1A (0.49) | HSP90AA1KDM1AKDM4CALDH1A1TDP1 | |
| SCHEMBL30792364 | 0.81 | KDM1A (0.49) | HSP90AA1KDM1AKDM4CALDH1A1TDP1 | |
| SCHEMBL31158155 | 0.80 | SMN1; SMN2 (0.45) | HSP90AA1ALDH1A1TDP1SMN1; SMN2NPC1 | |
| Hydrochloric Acid SCHEMBL7086589 | 0.79 | KDM1A (0.47) | HSP90AA1KDM1AKDM4CALDH1A1TDP1 | |
| Hydrochloric Acid SCHEMBL7089234 | 0.79 | KDM1A (0.47) | HSP90AA1KDM1AKDM4CALDH1A1TDP1 | |
| SCHEMBL9704689 | 0.75 | HSP90AA1 (0.46) | EGFRHSP90AA1ALDH1A1SMN1; SMN2NPC1 | |
| SCHEMBL7085680 | 0.75 | HSP90AA1 (0.42) | EGFRHSP90AA1KDM4CALDH1A1SMN1; SMN2 | |
| SCHEMBL6565668 | 0.74 | ALDH1A1 (0.52) | HSP90AA1IDO1ALDH1A1TDP1SMN1; SMN2 | |
| SCHEMBL29889875 | 0.74 | ALDH1A1 (0.52) | HSP90AA1IDO1ALDH1A1TDP1SMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0753542-A1 | Polyazo dyestuffs | BAYER AG (DE) | 1997-01-15 | — | — | EP | disclosed |