Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | HPGD | P15428 | 2/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 3/20 | 0.34 |
| ▸ | ATM | Q13315 | 1/20 | 0.34 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 3/20 | 0.33 |
| ▸ | PLA2G10 | O15496 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | RECQL | P46063 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.30 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.30 |
| ▸ | GSK3B | P49841 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL10869005 | 0.71 | SMN1; SMN2 (0.55) | ALDH1A1HPGDTP53TDP1MAPT | |
| SCHEMBL1799520 | 0.64 | — | — | |
| SCHEMBL9564367 | 0.64 | RAB9A (0.52) | ALDH1A1HPGDTP53MAPTLMNA | |
| SCHEMBL9564438 | 0.62 | RAB9A (0.58) | ALDH1A1HPGDTP53MAPTMEN1 | |
| SCHEMBL10874711 | 0.61 | EPHX2 (0.63) | TP53MAPTLMNASMN1; SMN2POLB | |
| Hydrochloric Acid SCHEMBL3888907 | 0.61 | THRB (0.39) | ALDH1A1HPGDTP53MAPTSMN1; SMN2 | |
| SCHEMBL15121187 | 0.60 | EGFR (0.56) | HPGDTDP1MAPTATMLMNA | |
| SCHEMBL12362660 | 0.58 | GSK3B (0.36) | ALDH1A1HPGDTP53TDP1MAPT | |
| SCHEMBL11689561 | 0.58 | ESR1 (0.61) | MAPTLMNAKMT2AGSK3B | |
| SCHEMBL22314810 | 0.58 | EGFR (0.41) | ALDH1A1HPGDTDP1MAPTLMNA |
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-0563686-A1 | Utilization of 3 substituted amino isoxazole derivatives against endoparasites, new 3 substituted amino isoxazols and process for their preparation | BAYER AG (DE) | 1993-10-06 | — | — | EP | disclosed |