Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 1/20 | 0.52 |
| ▸ | CA9 | Q16790 | 1/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.44 |
| ▸ | MEN1 | O00255 | 2/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | GSK3A | P49840 | 1/20 | 0.39 |
| ▸ | GSK3B | P49841 | 1/20 | 0.39 |
| ▸ | LPAR1 | Q92633 | 1/20 | 0.37 |
| ▸ | LPAR3 | Q9UBY5 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL10426001 | 0.69 | CA9 (0.54) | CA12CA9KMT2AMEN1KDM4E | |
| SCHEMBL7462959 | 0.69 | ALDH1A1 (0.61) | CA12CA9KMT2AMEN1KDM4E | |
| SCHEMBL860250 | 0.68 | CA12 (0.70) | CA12CA9KMT2AMEN1KDM4E | |
| SCHEMBL7503582 | 0.68 | CA12 (0.48) | CA12CA9KMT2AMEN1KDM4E | |
| SCHEMBL522649 | 0.68 | CA12 (1.00) | CA12CA9KMT2AMEN1KDM4E | |
| SCHEMBL29744481 | 0.68 | CA12 (1.00) | CA12CA9KMT2AMEN1KDM4E | |
| Hydrochloric Acid SCHEMBL7085111 | 0.67 | CA12 (0.96) | CA12CA9KMT2AMEN1KDM4E | |
| Phosphine SCHEMBL31113454 | 0.67 | CA12 (0.96) | CA12CA9KMT2AMEN1KDM4E | |
| SCHEMBL7290092 | 0.67 | HTT (0.56) | CA12CA9KMT2AMEN1ALDH1A1 | |
| SCHEMBL5336840 | 0.67 | HTT (0.56) | CA12CA9KMT2AMEN1ALDH1A1 |
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-2696878-B1 | DOSAGE REGIMEN FOR SAPACITABINE AND DECITABINE IN COMBINATION FOR TREATING ACUTE MYELOID LEUKEMIA | CYCLACEL LTD (GB) | 2019-07-10 | — | — | EP | disclosed |