Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.41 |
| ▸ | MAPT | P10636 | 5/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.41 |
| ▸ | HPGD | P15428 | 3/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 3/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 5/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 4/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.37 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.37 |
| ▸ | CASP1 | P29466 | 2/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | CASP7 | P55210 | 1/20 | 0.36 |
| ▸ | ADAM17 | P78536 | 2/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL14254851 | 0.77 | ADAM17 (0.39) | ALDH1A1CYP3A4CYP2C19TSHRSMN1; SMN2 | |
| SCHEMBL6211749 | 0.72 | HRH3 (0.40) | ALDH1A1HPGDNPSR1MEN1KMT2A | |
| SCHEMBL9261783 | 0.70 | GRIN2B (0.40) | ALDH1A1MAPTHSD17B10HPGDMEN1 | |
| SCHEMBL11954278 | 0.69 | TACR1 (0.46) | ALDH1A1MAPTHSD17B10HPGDMEN1 | |
| SCHEMBL31639956 | 0.68 | EPHX2 (0.44) | ALDH1A1MAPTHSD17B10HPGDNPSR1 | |
| SCHEMBL9752823 | 0.68 | MAOA (0.44) | ALDH1A1MAPTHSD17B10HPGDNPSR1 | |
| SCHEMBL7388419 | 0.67 | ALDH1A1 (0.40) | ALDH1A1MAPTHSD17B10HPGDNPSR1 | |
| SCHEMBL18987888 | 0.67 | ALDH1A1 (0.42) | ALDH1A1MAPTHSD17B10HPGDNPSR1 | |
| SCHEMBL4435678 | 0.67 | HRH3 (0.40) | ALDH1A1MAPTHPGDMEN1KMT2A | |
| Benzyl Alcohol SCHEMBL27670531 | 0.66 | ALDH1A1 (0.57) | ALDH1A1MAPTHSD17B10HPGDNPSR1 |
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-0384636-A1 | Pharmaceutically active compounds | FISONS plc (GB) | 1990-08-29 | — | — | EP | disclosed |