Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDH1 | O75874 | 15/20 | 0.51 |
| ▸ | HSD11B1 | P28845 | 2/20 | 0.44 |
| ▸ | MTOR | P42345 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL8475478 | 1.00 | IDH1 (0.51) | IDH1HSD11B1MTORALDH1A1CYP1A2 | |
| SCHEMBL6902727 | 0.79 | IDH1 (0.44) | IDH1HSD11B1ALDH1A1 | |
| SCHEMBL10308853 | 0.77 | IDH1 (0.48) | IDH1HSD11B1 | |
| SCHEMBL14846754 | 0.75 | IDH1 (0.64) | IDH1MTOR | |
| SCHEMBL14846820 | 0.75 | IDH1 (0.64) | IDH1MTOR | |
| SCHEMBL19178147 | 0.75 | IDH1 (0.64) | IDH1MTOR | |
| SCHEMBL2732938 | 0.74 | HSD11B1 (0.36) | IDH1HSD11B1ALDH1A1CYP1A2CYP2C9 | |
| SCHEMBL8475165 | 0.73 | GAA (0.36) | IDH1HSD11B1ALDH1A1CYP1A2CYP2C9 | |
| SCHEMBL8475167 | 0.73 | GAA (0.36) | IDH1HSD11B1ALDH1A1CYP1A2CYP2C9 | |
| SCHEMBL3570167 | 0.72 | IDH1 (0.38) | IDH1HSD11B1ALDH1A1CYP1A2CYP2C9 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5939554-A | Diarylaminopropanediol and diarylmethyl-oxazolidinone compounds | NDSU RESEARCH FOUNDATION (US) | 1999-08-17 | — | — | US | disclosed |
| US-5623087-A | Method for preparation of optically active diarylalanines | NDSU-RESEARCH FOUNDATION (US) | 1997-04-22 | — | — | US | disclosed |