Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | VCAM1 | P19320 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.46 |
| ▸ | AR | P10275 | 1/20 | 0.44 |
| ▸ | PELP1 | Q8IZL8 | 1/20 | 0.44 |
| ▸ | PKM | P14618 | 1/20 | 0.43 |
| ▸ | CA12 | O43570 | 1/20 | 0.42 |
| ▸ | CA1 | P00915 | 1/20 | 0.42 |
| ▸ | CA2 | P00918 | 1/20 | 0.42 |
| ▸ | CA7 | P43166 | 1/20 | 0.42 |
| ▸ | XDH | P47989 | 1/20 | 0.42 |
| ▸ | CA9 | Q16790 | 1/20 | 0.42 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.42 |
| ▸ | ABCB1 | P08183 | 4/20 | 0.41 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | TPMT | P51580 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL3352532 | 0.94 | VCAM1 (0.54) | VCAM1ALDH1A1HPGDNPSR1AR | |
| SCHEMBL2484778 | 0.87 | VCAM1 (0.57) | VCAM1ALDH1A1HPGDNPSR1PKM | |
| SCHEMBL8768519 | 0.85 | VCAM1 (0.46) | VCAM1ALDH1A1HPGDNPSR1AR | |
| SCHEMBL3354100 | 0.82 | KMT2A (0.53) | ALDH1A1PKMMAPTGAAPOLB | |
| SCHEMBL29433264 | 0.82 | XDH (0.61) | VCAM1ALDH1A1HPGDNPSR1AR | |
| SCHEMBL223930 | 0.82 | XDH (0.61) | VCAM1ALDH1A1HPGDNPSR1AR | |
| SCHEMBL2797670 | 0.81 | MAPT (0.51) | VCAM1ALDH1A1HPGDNPSR1AR | |
| SCHEMBL7031271 | 0.80 | VCAM1 (0.63) | VCAM1ALDH1A1HPGDNPSR1AR | |
| SCHEMBL2797668 | 0.79 | TPMT (0.58) | VCAM1ALDH1A1HPGDCA12CA1 | |
| SCHEMBL2934710 | 0.78 | MAPT (0.57) | ALDH1A1NPSR1PKMCA12CA1 |
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-0791576-A2 | Leukotriene antagonistic benzoic acid derivatives | BAYER AG (DE) | 1997-08-27 | — | — | EP | disclosed |