Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.42 |
| ▸ | PDE7A | Q13946 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 2/20 | 0.36 |
| ▸ | POLB | P06746 | 2/20 | 0.36 |
| ▸ | GLA | P06280 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | S1PR4 | O95977 | 1/20 | 0.35 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 2/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.33 |
| ▸ | IDO1 | P14902 | 1/20 | 0.33 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.33 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.33 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.33 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.33 |
| ▸ | TXNRD1 | Q16881 | 1/20 | 0.33 |
| ▸ | TXNRD3 | Q86VQ6 | 1/20 | 0.33 |
| ▸ | TXNRD2 | Q9NNW7 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL31481307 | 0.79 | ALDH1A1 (0.42) | ALDH1A1TSHRPOLBGLAS1PR4 | |
| SCHEMBL29004839 | 0.79 | S1PR4 (0.46) | ALDH1A1PDE7ATSHRGAAS1PR4 | |
| SCHEMBL8563266 | 0.78 | ALDH1A1 (0.36) | ALDH1A1POLBS1PR4HPGDALOX15 | |
| SCHEMBL8566378 | 0.77 | ALDH1A1 (0.36) | ALDH1A1TSHRHPGDALOX15IDO1 | |
| SCHEMBL8562235 | 0.76 | TDP1 (0.48) | ALDH1A1TSHRPOLBHPGDALOX15 | |
| SCHEMBL8568828 | 0.76 | TDP1 (0.48) | ALDH1A1TSHRPOLBHPGDALOX15 | |
| SCHEMBL8566803 | 0.74 | ALOX15 (0.44) | ALDH1A1TSHRGAAHPGDALOX15 | |
| SCHEMBL28076647 | 0.73 | MAPT (0.45) | ALDH1A1TSHRGAAS1PR4HPGD | |
| SCHEMBL29601287 | 0.71 | GLA (0.45) | TSHRPOLBGLAGAA | |
| SCHEMBL21031807 | 0.71 | GLA (0.45) | TSHRPOLBGLAGAA |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0735025-B1 | Process for producing aminonitropyridines | SUMITOMO CHEMICAL CO (JP) | 1998-07-01 | — | — | EP | disclosed |
| US-5648496-A | AMINATION | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 1997-07-15 | — | — | US | disclosed |
| EP-0735025-A1 | Process for producing aminonitropyridines | SUMITOMO CHEMICAL COMPANY LIMITED (JP) | 1996-10-02 | — | — | EP | disclosed |