Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 1/20 | 0.35 |
| ▸ | CA1 | P00915 | 1/20 | 0.35 |
| ▸ | CA2 | P00918 | 1/20 | 0.35 |
| ▸ | CA9 | Q16790 | 1/20 | 0.35 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.35 |
| ▸ | CDC7 | O00311 | 1/20 | 0.35 |
| ▸ | DBF4 | Q9UBU7 | 1/20 | 0.35 |
| ▸ | NUDT1 | P36639 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | GLA | P06280 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.32 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.32 |
| ▸ | CSNK1D | P48730 | 1/20 | 0.31 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.31 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.31 |
| ▸ | ELANE | P08246 | 1/20 | 0.30 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.30 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL29582835 | 1.00 | CA12 (0.35) | CA12CA1CA2CA9CA14 | |
| SCHEMBL24398974 | 0.87 | POLQ (0.35) | CA12CA1CA2CA9CA14 | |
| SCHEMBL24422793 | 0.80 | KDM6B (0.32) | CA12CA1CA2CA9CA14 | |
| SCHEMBL1797967 | 0.76 | KDM4E (0.41) | KDM4EALDH1A1GLAGAAMEN1 | |
| SCHEMBL31438561 | 0.74 | NAMPT (0.39) | CA12CA1CA2CA9CA14 | |
| SCHEMBL14159678 | 0.73 | CA12 (0.49) | CA12CA1CA2CA9CA14 | |
| SCHEMBL6634098 | 0.73 | SIRT3 (0.49) | CA12CA1CA2CA9CA14 | |
| SCHEMBL15596168 | 0.73 | CHRNB2 (0.47) | CA12CA1CA2CA9CA14 | |
| SCHEMBL24422794 | 0.72 | HPGDS (0.39) | KDM4EALDH1A1GLAGAAMEN1 | |
| SCHEMBL24423691 | 0.72 | ALDH1A1 (0.39) | KDM4EALDH1A1GLAGAAMEN1 |
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-2022098992-A1 | USE OF MACROCYCLIC COMPOUNDS IN METHODS OF TREATING CANCER | SCORPION THERAPEUTICS, INC. (US) | 2022-05-12 | — | — | WO | disclosed |