Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.67 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.67 |
| ▸ | CA12 | O43570 | 4/20 | 0.67 |
| ▸ | CA2 | P00918 | 4/20 | 0.67 |
| ▸ | CA6 | P23280 | 4/20 | 0.67 |
| ▸ | CA7 | P43166 | 4/20 | 0.67 |
| ▸ | CA9 | Q16790 | 4/20 | 0.67 |
| ▸ | CA14 | Q9ULX7 | 4/20 | 0.67 |
| ▸ | CA5B | Q9Y2D0 | 4/20 | 0.67 |
| ▸ | HPGD | P15428 | 3/20 | 0.67 |
| ▸ | CA3 | P07451 | 3/20 | 0.67 |
| ▸ | CA5A | P35218 | 3/20 | 0.67 |
| ▸ | ATM | Q13315 | 1/20 | 0.55 |
| ▸ | MAOB | P27338 | 10/20 | 0.55 |
| ▸ | CA1 | P00915 | 2/20 | 0.52 |
| ▸ | MAOA | P21397 | 2/20 | 0.52 |
| ▸ | GAA | P10253 | 1/20 | 0.52 |
| ▸ | MEN1 | O00255 | 1/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.51 |
| ▸ | CA4 | P22748 | 2/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL17903545 | 0.84 | MAOB (0.72) | KDM4EALDH1A1CA12CA2CA6 | |
| SCHEMBL29985431 | 0.84 | KDM4E (0.68) | KDM4EALDH1A1CA12CA2CA6 | |
| SCHEMBL18589240 | 0.84 | MAOB (0.70) | KDM4EALDH1A1CA12CA2CA6 | |
| SCHEMBL6835643 | 0.82 | KDM4E (0.76) | KDM4EALDH1A1CA12CA2CA6 | |
| SCHEMBL22502678 | 0.82 | MEN1 (0.72) | KDM4EALDH1A1CA12CA2CA6 | |
| SCHEMBL1808756 | 0.82 | MAOA (0.71) | KDM4EALDH1A1CA12CA2CA6 | |
| SCHEMBL29575367 | 0.81 | CA12 (0.65) | KDM4EALDH1A1CA12CA2CA6 | |
| SCHEMBL18752472 | 0.81 | CA12 (0.82) | KDM4EALDH1A1CA12CA2CA6 | |
| SCHEMBL76086 | 0.80 | KDM4E (1.00) | KDM4EALDH1A1CA12CA2CA6 | |
| SCHEMBL5858940 | 0.80 | LMNA (0.47) | KDM4EALDH1A1CA12CA2CA6 |
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-0123543-B1 | LEUKOTRIENE ANTAGONISTS, THEIR PRODUCTION AND USE AND COMPOSITIONS CONTAINING THEM | MERCK FROSST CANADA INC. (CA) | 1988-02-03 | — | — | EP | disclosed |
| US-4609744-A | 4-oxo-benzopyran carboxylic acids | MERCK FROSST CANADA INC. (CA) | 1986-09-02 | — | — | US | disclosed |
| EP-0123543-A1 | Leukotriene antagonists, their production and use and compositions containing them | MERCK FROSST CANADA INC. (CA) | 1984-10-31 | — | — | EP | disclosed |