Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.55 |
| ▸ | GAA | P10253 | 2/20 | 0.55 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.55 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.55 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.55 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.55 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.55 |
| ▸ | POLB | P06746 | 4/20 | 0.51 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.48 |
| ▸ | HPGD | P15428 | 3/20 | 0.48 |
| ▸ | MEN1 | O00255 | 2/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.45 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.45 |
| ▸ | XBP1 | P17861 | 1/20 | 0.45 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL11178712 | 0.87 | POLB (0.55) | ALDH1A1GAACYP2D6POLBL3MBTL1 | |
| SCHEMBL11200220 | 0.85 | POLB (0.54) | ALDH1A1GAACYP2C9CYP2C19POLB | |
| SCHEMBL11198118 | 0.85 | POLB (0.54) | ALDH1A1GAAPOLBL3MBTL1KDM4E | |
| SCHEMBL11165965 | 0.83 | MCHR1 (0.55) | CYP2D6POLBHSD17B10TSHRLMNA | |
| SCHEMBL11165531 | 0.83 | MCHR1 (0.55) | CYP2D6POLBHSD17B10TSHRLMNA | |
| SCHEMBL10356773 | 0.83 | MCHR1 (0.55) | CYP2D6POLBHSD17B10TSHRLMNA | |
| SCHEMBL11194691 | 0.83 | POLB (0.52) | ALDH1A1GAACYP2C9CYP2C19CYP1A2 | |
| SCHEMBL11441498 | 0.82 | MCHR1 (0.56) | GAACYP2C19CYP1A2CYP2D6POLB | |
| SCHEMBL11173931 | 0.81 | POLB (0.49) | ALDH1A1GAAPOLBL3MBTL1KDM4E | |
| SCHEMBL11184839 | 0.80 | ALDH1A1 (0.61) | ALDH1A1CYP2C9CYP2C19CYP1A2CYP3A4 |
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-0023569-A1 | Derivatives of carboxylic acids, their preparation and medicaments containing them | Dr. Karl Thomae GmbH (DE) | 1981-02-11 | — | — | EP | disclosed |