Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 6/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.42 |
| ▸ | HPGD | P15428 | 2/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.42 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.42 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.42 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.42 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.42 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.42 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.42 |
| ▸ | MAOA | P21397 | 1/20 | 0.42 |
| ▸ | DRD1 | P21728 | 1/20 | 0.42 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.42 |
| ▸ | HTR2B | P41595 | 1/20 | 0.42 |
| ▸ | CCR2 | P41597 | 1/20 | 0.42 |
| ▸ | CA1 | P00915 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
| ▸ | CA9 | Q16790 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL1754863 | 0.78 | ALDH1A1 (0.39) | CYP1A2ALDH1A1HSD17B10HPGDTDP1 | |
| SCHEMBL153241 | 0.76 | CYP1A2 (0.46) | CYP1A2ALDH1A1HSD17B10HPGDTDP1 | |
| SCHEMBL2915678 | 0.76 | CYP1A2 (0.46) | CYP1A2ALDH1A1HSD17B10HPGDTDP1 | |
| SCHEMBL6382915 | 0.73 | TDP1 (0.43) | CYP1A2ALDH1A1HSD17B10HPGDTDP1 | |
| SCHEMBL7916289 | 0.71 | SIGMAR1 (0.43) | CYP1A2ALDH1A1HSD17B10HPGDTDP1 | |
| SCHEMBL6377841 | 0.69 | TDP1 (0.40) | CYP1A2ALDH1A1HSD17B10HPGDTDP1 | |
| SCHEMBL5175738 | 0.69 | POLB (0.41) | ALDH1A1HSD17B10HPGDTDP1CA1 | |
| SCHEMBL13241505 | 0.68 | CA1 (0.57) | CYP1A2ALDH1A1HSD17B10CYP3A4MAOA | |
| SCHEMBL7449481 | 0.68 | DHODH (0.45) | CYP1A2ALDH1A1HSD17B10HPGDTDP1 | |
| SCHEMBL31126043 | 0.68 | ALDH1A1 (0.54) | CYP1A2ALDH1A1HSD17B10HPGDTDP1 |
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 |
|---|---|---|---|---|---|---|---|
| US-4845203-A | FOR CELLULOSE FIBERS | CIBA-GEIGY CORPORATION (US) | 1989-07-04 | — | — | US | disclosed |