Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.61 |
| ▸ | HPGD | P15428 | 4/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.49 |
| ▸ | MAPT | P10636 | 2/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.47 |
| ▸ | POLB | P06746 | 2/20 | 0.47 |
| ▸ | CES2 | O00748 | 1/20 | 0.47 |
| ▸ | GALR3 | O60755 | 1/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.47 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.47 |
| ▸ | CASP1 | P29466 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | GAA | P10253 | 1/20 | 0.45 |
| ▸ | RECQL | P46063 | 1/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.44 |
| ▸ | MEN1 | O00255 | 2/20 | 0.44 |
| ▸ | GLA | P06280 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL18163 | 1.00 | ALDH1A1 (0.61) | ALDH1A1HPGDCYP1A2MAPTKMT2A | |
| SCHEMBL28545012 | 0.83 | ALDH1A1 (0.61) | ALDH1A1HPGDCYP1A2MAPTKMT2A | |
| SCHEMBL30249448 | 0.83 | ALDH1A1 (0.63) | ALDH1A1HPGDCYP1A2MAPTKMT2A | |
| SCHEMBL18214 | 0.83 | ALDH1A1 (0.63) | ALDH1A1HPGDCYP1A2MAPTKMT2A | |
| SCHEMBL30526110 | 0.83 | FLT1 (0.49) | ALDH1A1HPGDCYP1A2MAPTKMT2A | |
| SCHEMBL257466 | 0.83 | FLT1 (0.49) | ALDH1A1HPGDCYP1A2MAPTKMT2A | |
| SCHEMBL31173096 | 0.82 | HPGD (0.50) | ALDH1A1HPGDCYP1A2MAPTKMT2A | |
| SCHEMBL1330174 | 0.81 | ALDH1A1 (0.59) | ALDH1A1HPGDCYP1A2MAPTKMT2A | |
| SCHEMBL10462650 | 0.81 | ALDH1A1 (0.61) | ALDH1A1HPGDCYP1A2MAPTKMT2A | |
| SCHEMBL1396978 | 0.81 | ALDH1A1 (0.65) | ALDH1A1HPGDCYP1A2MAPTKMT2A |
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-4161912-A1 | PREPARATION OF HIGHLY PURE AMORPHOUS DAPAGLIFLOZIN | KRKA, d.d., Novo mesto (SI) | 2023-04-12 | — | — | EP | disclosed |