Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.42 |
| ▸ | HPGD | P15428 | 5/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.42 |
| ▸ | MEN1 | O00255 | 4/20 | 0.42 |
| ▸ | MAPT | P10636 | 2/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.40 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.40 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.40 |
| ▸ | USP2 | O75604 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | HTR1A | P08908 | 1/20 | 0.35 |
| ▸ | DRD2 | P14416 | 1/20 | 0.35 |
| ▸ | HTR2A | P28223 | 1/20 | 0.35 |
| ▸ | HTR7 | P34969 | 1/20 | 0.35 |
| ▸ | HTR6 | P50406 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL421711 | 0.89 | ALDH1A1 (0.49) | ALDH1A1HPGDKMT2AMEN1MAPT | |
| SCHEMBL8841078 | 0.79 | SLC6A2 (0.45) | ALDH1A1HPGDKMT2AMEN1MAPT | |
| SCHEMBL10359840 | 0.78 | CYP2D6 (0.42) | ALDH1A1HPGDKMT2AMEN1SMN1; SMN2 | |
| SCHEMBL11012886 | 0.74 | KMT2A (0.47) | ALDH1A1KMT2AMEN1CYP1A2CYP3A4 | |
| SCHEMBL2962387 | 0.74 | KMT2A (0.47) | ALDH1A1KMT2AMEN1CYP1A2CYP3A4 | |
| SCHEMBL2856043 | 0.74 | ALDH1A1 (0.46) | ALDH1A1HPGDKMT2AMEN1MAPT | |
| SCHEMBL10709666 | 0.73 | ADRA2A (0.49) | ALDH1A1HPGDKMT2AMEN1MAPT | |
| SCHEMBL30587766 | 0.73 | ADRA2A (0.49) | ALDH1A1HPGDKMT2AMEN1MAPT | |
| SCHEMBL220092 | 0.73 | ADRA2A (0.49) | ALDH1A1HPGDKMT2AMEN1MAPT | |
| SCHEMBL7913213 | 0.71 | ALDH1A1 (0.44) | ALDH1A1HPGDKMT2AMEN1MAPT |
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-0414631-A1 | Auxiliary agent mixture and its use in dyeing polyester fibre materials | CIBA-GEIGY AG (CH) | 1991-02-27 | — | — | EP | disclosed |