Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.48 |
| ▸ | TSHR | P16473 | 6/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.48 |
| ▸ | THRB | P10828 | 2/20 | 0.48 |
| ▸ | RECQL | P46063 | 2/20 | 0.48 |
| ▸ | HPGD | P15428 | 1/20 | 0.48 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.48 |
| ▸ | CASP1 | P29466 | 1/20 | 0.48 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.46 |
| ▸ | CA12 | O43570 | 3/20 | 0.39 |
| ▸ | CA1 | P00915 | 3/20 | 0.39 |
| ▸ | CA2 | P00918 | 3/20 | 0.39 |
| ▸ | CA7 | P43166 | 3/20 | 0.39 |
| ▸ | CA9 | Q16790 | 3/20 | 0.39 |
| ▸ | CA14 | Q9ULX7 | 3/20 | 0.39 |
| ▸ | CA4 | P22748 | 2/20 | 0.39 |
| ▸ | CA6 | P23280 | 2/20 | 0.39 |
| ▸ | CA5A | P35218 | 2/20 | 0.39 |
| ▸ | CA5B | Q9Y2D0 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL8164868 | 0.86 | ALDH1A1 (0.46) | ALDH1A1TSHRHSD17B10CYP3A4THRB | |
| SCHEMBL11097853 | 0.85 | ALDH1A1 (0.47) | ALDH1A1TSHRHSD17B10CYP3A4THRB | |
| SCHEMBL9232347 | 0.82 | ALDH1A1 (0.44) | ALDH1A1TSHRHSD17B10CYP3A4THRB | |
| SCHEMBL4991882 | 0.82 | ALDH1A1 (0.44) | ALDH1A1TSHRHSD17B10CYP3A4THRB | |
| SCHEMBL6939244 | 0.81 | TTR (0.46) | ALDH1A1TSHRHSD17B10CYP3A4THRB | |
| SCHEMBL8019424 | 0.80 | CYP2C9 (0.56) | ALDH1A1TSHRHSD17B10CYP3A4THRB | |
| SCHEMBL5181911 | 0.79 | ALDH1A1 (0.41) | ALDH1A1TSHRHSD17B10CYP3A4THRB | |
| SCHEMBL10548795 | 0.77 | AURKA (0.47) | ALDH1A1TSHRHSD17B10CYP3A4THRB | |
| SCHEMBL8030690 | 0.76 | ALDH1A1 (0.50) | ALDH1A1TSHRHSD17B10CYP3A4THRB | |
| SCHEMBL19206145 | 0.76 | CYP3A4 (0.41) | ALDH1A1TSHRHSD17B10CYP3A4THRB |
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-5021557-A | Copper-containing formazan dye, colorfast blue shades on cellulose | CIBA-GEIGY CORPORATION (US) | 1991-06-04 | — | — | US | disclosed |