Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.33 |
| ▸ | HPGD | P15428 | 2/20 | 0.33 |
| ▸ | TSHR | P16473 | 2/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | ALPL | P05186 | 1/20 | 0.32 |
| ▸ | CPB2 | Q96IY4 | 6/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.31 |
| ▸ | CASP1 | P29466 | 1/20 | 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 | |
|---|---|---|---|---|
| Trifluoroacetic Acid SCHEMBL30548563 | 0.79 | TSHR (0.34) | ALDH1A1HPGDTSHRL3MBTL1LMNA | |
| SCHEMBL3225586 | 0.75 | — | — | |
| SCHEMBL24360898 | 0.75 | ALDH1A1 (0.32) | ALDH1A1SMN1; SMN2HSD17B10HPGDTSHR | |
| SCHEMBL10441261 | 0.75 | ALDH1A1 (0.36) | ALDH1A1SMN1; SMN2HSD17B10HPGDTSHR | |
| SCHEMBL60409 | 0.72 | KDM4E (0.33) | ALDH1A1HPGDKDM4EGAATDP1 | |
| SCHEMBL6469498 | 0.72 | KDM4E (0.33) | ALDH1A1HPGDKDM4EGAATDP1 | |
| SCHEMBL6245109 | 0.72 | KDM4E (0.33) | ALDH1A1HPGDKDM4EGAATDP1 | |
| SCHEMBL13276440 | 0.72 | KDM4E (0.33) | ALDH1A1HPGDKDM4EGAATDP1 | |
| SCHEMBL10530234 | 0.72 | KDM4E (0.33) | ALDH1A1HPGDKDM4EGAATDP1 | |
| SCHEMBL24360890 | 0.72 | — | — |
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-0541086-A1 | Antibacterial 6-fluoro-quinolones having an oxime group on the substituent in position 7 | Kaken Pharmaceutical Co., Ltd. (JP) | 1993-05-12 | — | — | EP | disclosed |