Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 5/20 | 0.46 |
| ▸ | CA1 | P00915 | 5/20 | 0.46 |
| ▸ | CA2 | P00918 | 5/20 | 0.46 |
| ▸ | CA7 | P43166 | 5/20 | 0.46 |
| ▸ | CA9 | Q16790 | 5/20 | 0.46 |
| ▸ | CA14 | Q9ULX7 | 5/20 | 0.46 |
| ▸ | MEN1 | O00255 | 2/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | MAPT | P10636 | 2/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.46 |
| ▸ | ELANE | P08246 | 5/20 | 0.45 |
| ▸ | F2 | P00734 | 1/20 | 0.45 |
| ▸ | PLAU | P00749 | 1/20 | 0.45 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | HPGD | P15428 | 2/20 | 0.40 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL364931 | 0.85 | NR4A2 (0.50) | CA12CA1CA2CA7CA9 | |
| SCHEMBL364761 | 0.81 | KDM4E (0.52) | CA12CA1CA2CA7CA9 | |
| SCHEMBL365621 | 0.79 | MAPT (0.53) | CA12CA1CA2CA7CA9 | |
| SCHEMBL365400 | 0.79 | ELANE (0.47) | MEN1KMT2AALDH1A1MAPTELANE | |
| SCHEMBL366888 | 0.78 | EGFR (0.44) | MEN1KMT2AALDH1A1POLBGAA | |
| SCHEMBL365562 | 0.78 | CYP3A4 (0.46) | MEN1KMT2AALDH1A1MAPTGAA | |
| SCHEMBL364154 | 0.78 | MAPT (0.39) | CA12CA1CA2CA7CA9 | |
| SCHEMBL365894 | 0.77 | TSHR (0.48) | MEN1KMT2AALDH1A1MAPK1ELANE | |
| SCHEMBL367201 | 0.77 | EGFR (0.45) | ALDH1A1ELANEKDM4ENR4A2 | |
| SCHEMBL366408 | 0.76 | ALDH1A1 (0.52) | MEN1KMT2AALDH1A1MAPTPOLB |
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 |
|---|---|---|---|---|---|---|---|
| WO-2012007007-A1 | INHIBITORS OF HDME | EPITHERAPEUTICS APS (DK) | 2012-01-19 | — | — | WO | disclosed |