Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 9/20 | 0.65 |
| ▸ | CA1 | P00915 | 7/20 | 0.65 |
| ▸ | CA9 | Q16790 | 5/20 | 0.65 |
| ▸ | CA12 | O43570 | 3/20 | 0.65 |
| ▸ | MMP1 | P03956 | 1/20 | 0.61 |
| ▸ | MMP2 | P08253 | 1/20 | 0.61 |
| ▸ | MMP9 | P14780 | 1/20 | 0.61 |
| ▸ | MMP8 | P22894 | 1/20 | 0.61 |
| ▸ | MMP13 | P45452 | 1/20 | 0.61 |
| ▸ | CA4 | P22748 | 2/20 | 0.53 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.53 |
| ▸ | KIF11 | P52732 | 1/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.52 |
| ▸ | GAA | P10253 | 1/20 | 0.52 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.50 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.50 |
| ▸ | PTGES2 | Q9H7Z7 | 1/20 | 0.50 |
| ▸ | TSHR | P16473 | 1/20 | 0.50 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.50 |
| ▸ | CES2 | O00748 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL962772 | 1.00 | CA2 (0.65) | CA2CA1CA9CA12MMP1 | |
| SCHEMBL8043466 | 0.98 | CA2 (0.63) | CA2CA1CA9CA12MMP1 | |
| Potassium SCHEMBL8043470 | 0.98 | CA2 (0.63) | CA2CA1CA9CA12MMP1 | |
| SCHEMBL27811943 | 0.98 | CA2 (0.63) | CA2CA1CA9CA12MMP1 | |
| Hydrochloric Acid SCHEMBL29969413 | 0.98 | CA2 (0.63) | CA2CA1CA9CA12MMP1 | |
| Trifluoroacetic Acid SCHEMBL29695834 | 0.90 | CA1 (0.63) | CA2CA1CA9CA12MMP1 | |
| Benzoic Acid SCHEMBL22653517 | 0.86 | SRD5A2 (0.61) | CA2CA1CA9CA12MMP1 | |
| SCHEMBL8863056 | 0.83 | CA1 (0.65) | CA2CA1MMP1MMP2MMP9 | |
| SCHEMBL30859041 | 0.83 | CA1 (0.65) | CA2CA1MMP1MMP2MMP9 | |
| SCHEMBL12841398 | 0.82 | CA2 (0.59) | CA2CA1CA9CA12CA4 |
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-2022159745-A1 | GCN2 MODULATING COMPOUNDS AND USES THEREOF | HIBERCELL, INC. (US) | 2022-07-28 | — | — | WO | disclosed |