Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.31 |
| ▸ | MEN1 | O00255 | 2/20 | 0.31 |
| ▸ | LMNA | P02545 | 2/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | PKM | P14618 | 1/20 | 0.31 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | THRB | P10828 | 1/20 | 0.31 |
| ▸ | BLM | P54132 | 1/20 | 0.31 |
| ▸ | BTK | Q06187 | 1/20 | 0.31 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.31 |
| ▸ | PLK3 | Q9H4B4 | 1/20 | 0.31 |
| ▸ | TGM2 | P21980 | 2/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL16167178 | 0.72 | SIGMAR1 (0.41) | ALDH1A1LMNABTKNPSR1TGM2 | |
| SCHEMBL16095632 | 0.65 | EGFR (0.39) | ALDH1A1LMNABTKTGM2CYP2C19 | |
| SCHEMBL31289612 | 0.64 | MAPK3 (0.37) | ALDH1A1KMT2AMEN1LMNAGAA | |
| SCHEMBL4654542 | 0.63 | ALDH1A1 (0.39) | ALDH1A1KMT2AMEN1LMNACYP1A2 | |
| SCHEMBL11428595 | 0.58 | FAAH (0.30) | — | |
| SCHEMBL19643823 | 0.57 | MEN1 (0.54) | ALDH1A1KMT2AMEN1LMNACYP1A2 | |
| SCHEMBL3663002 | 0.57 | DGAT1 (0.38) | ALDH1A1LMNACYP1A2CYP2C9ALOX15 | |
| SCHEMBL16684492 | 0.57 | HPGD (0.33) | ALDH1A1KMT2AMEN1LMNACYP3A4 | |
| SCHEMBL2787330 | 0.55 | HSP90AA1 (0.41) | ALDH1A1LMNAALOX15TSHR | |
| SCHEMBL9485990 | 0.55 | CCR5 (0.42) | ALDH1A1ALOX15 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3099309-A1 | CHEMOTHERAPEUTIC DRUG COMBINATION | Yeditepe Universitesi (TR) | 2016-12-07 | — | — | EP | disclosed |
| WO-2015116012-A1 | CHEMOTHERAPEUTIC DRUG COMBINATION | YEDITEPE UNIVERSITESI (TR) | 2015-08-06 | — | — | WO | disclosed |