Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDH1 | O75874 | 5/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.36 |
| ▸ | MEN1 | O00255 | 4/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.36 |
| ▸ | GPBAR1 | Q8TDU6 | 1/20 | 0.35 |
| ▸ | GHSR | Q92847 | 1/20 | 0.35 |
| ▸ | ATM | Q13315 | 2/20 | 0.34 |
| ▸ | LMNA | P02545 | 2/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | GLA | P06280 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL19216587 | 0.75 | IDH1 (0.51) | IDH1GPBAR1GHSRLMNATSHR | |
| SCHEMBL19216781 | 0.75 | IDH1 (0.55) | IDH1 | |
| SCHEMBL19216694 | 0.74 | IDH1 (0.55) | IDH1 | |
| SCHEMBL19216780 | 0.69 | IDH1 (0.56) | IDH1KMT2AMEN1SMN1; SMN2GPBAR1 | |
| SCHEMBL19216531 | 0.68 | IDH1 (0.58) | IDH1KMT2A | |
| SCHEMBL19216534 | 0.67 | IDH1 (0.52) | IDH1 | |
| SCHEMBL19216570 | 0.65 | IDH1 (0.52) | IDH1 | |
| SCHEMBL19216615 | 0.65 | IDH1 (0.46) | IDH1 | |
| SCHEMBL19216592 | 0.65 | IDH1 (0.53) | IDH1LMNAALDH1A1GAA | |
| SCHEMBL19532678 | 0.65 | IDH1 (0.48) | IDH1LMNAALDH1A1GAA |
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-3202766-A1 | ISOXAZOLE DERIVATIVE AS MUTATED ISOCITRATE DEHYDROGENASE 1 INHIBITOR | DAIICHI SANKYO COMPANY, LIMITED (JP) | 2017-08-09 | — | — | EP | disclosed |