Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 2/20 | 0.51 |
| ▸ | CA1 | P00915 | 2/20 | 0.51 |
| ▸ | CA2 | P00918 | 2/20 | 0.51 |
| ▸ | CA7 | P43166 | 2/20 | 0.51 |
| ▸ | CA9 | Q16790 | 2/20 | 0.51 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.51 |
| ▸ | ESR1 | P03372 | 1/20 | 0.51 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.51 |
| ▸ | LMNA | P02545 | 1/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.50 |
| ▸ | MAOA | P21397 | 1/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.47 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.47 |
| ▸ | PDK3 | Q15120 | 1/20 | 0.47 |
| ▸ | PDK4 | Q16654 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL6902380 | 0.82 | GSK3B (0.48) | CA2LMNAKMT2AALDH1A1SMN1; SMN2 | |
| SCHEMBL6902376 | 0.82 | GSK3B (0.48) | CA2LMNAKMT2AALDH1A1SMN1; SMN2 | |
| SCHEMBL11900204 | 0.79 | CA1 (0.59) | CA12CA1CA2CA7CA9 | |
| SCHEMBL6900403 | 0.78 | HDAC3 (0.53) | LMNAALDH1A1HTTNPC1MAPT | |
| SCHEMBL6900410 | 0.78 | HDAC3 (0.53) | LMNAALDH1A1HTTNPC1MAPT | |
| SCHEMBL27647572 | 0.78 | CA1 (0.79) | CA12CA1CA2CA7CA9 | |
| SCHEMBL87450 | 0.76 | CA1 (0.83) | CA12CA1CA2CA7CA9 | |
| SCHEMBL6904340 | 0.76 | GSK3B (0.50) | LMNAKMT2AALDH1A1NPC1MAPT | |
| SCHEMBL6900441 | 0.76 | GSK3B (0.50) | LMNAKMT2AALDH1A1NPC1MAPT | |
| SCHEMBL6897949 | 0.75 | TSHR (0.55) | LMNACYP1A2CYP3A4KMT2AALDH1A1 |
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-2182809-B1 | THERAPEUTIC ISOXAZOLE COMPOUNDS | DART NEUROSCIENCE (CAYMAN) LTD (KY) | 2018-01-17 | — | — | EP | disclosed |