Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CPT1A | P50416 | 2/20 | 0.35 |
| ▸ | CPT1B | Q92523 | 2/20 | 0.35 |
| ▸ | CPT2 | P23786 | 1/20 | 0.35 |
| ▸ | TP53 | P04637 | 3/20 | 0.33 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
| ▸ | STING1 | Q86WV6 | 1/20 | 0.33 |
| ▸ | THRB | P10828 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.33 |
| ▸ | ALDH2 | P05091 | 1/20 | 0.32 |
| ▸ | ALDH3A1 | P30838 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.32 |
| ▸ | THPO | P40225 | 1/20 | 0.32 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.32 |
| ▸ | CRHR1 | P34998 | 2/20 | 0.32 |
| ▸ | CRHR2 | Q13324 | 2/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | GMNN | O75496 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL20686145 | 0.85 | ALDH1A1 (0.38) | TP53LMNAALDH1A1MEN1KMT2A | |
| SCHEMBL20686177 | 0.76 | MAP4K1 (0.36) | — | |
| SCHEMBL7837760 | 0.76 | TP53 (0.44) | TP53LMNACYP3A4CYP2D6CYP2C9 | |
| SCHEMBL17275768 | 0.72 | MEN1 (0.40) | TP53LMNAALDH1A1CYP3A4CYP2D6 | |
| SCHEMBL11919100 | 0.70 | MAPT (0.39) | TP53LMNATHRBALDH1A1CYP3A4 | |
| SCHEMBL10698603 | 0.70 | ALDH1A1 (0.39) | LMNAALDH1A1MEN1KMT2AHSD17B10 | |
| SCHEMBL7836213 | 0.69 | TP53 (0.46) | TP53LMNAALDH1A1CYP2C9CRHR2 | |
| SCHEMBL16364429 | 0.69 | PIK3CD (0.38) | CRHR1CRHR2 | |
| SCHEMBL10698666 | 0.69 | MEN1 (0.41) | TP53LMNAALDH1A1MEN1KMT2A | |
| SCHEMBL11916096 | 0.69 | ALDH1A1 (0.36) | CPT1ACPT1BCPT2TP53LMNA |
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-3145923-B1 | INDOLIN-2-ONE AND 1,3-DIHYDRO-PYRROLO[3,2-C]PYRIDIN-2-ONE DERIVATIVES | HOFFMANN LA ROCHE (CH) | 2019-01-30 | — | — | EP | disclosed |