Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 3/20 | 0.36 |
| ▸ | HTR6 | P50406 | 6/20 | 0.34 |
| ▸ | HTT | P42858 | 3/20 | 0.34 |
| ▸ | HRH4 | Q9H3N8 | 3/20 | 0.34 |
| ▸ | CA1 | P00915 | 2/20 | 0.33 |
| ▸ | CA9 | Q16790 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | CA12 | O43570 | 1/20 | 0.33 |
| ▸ | CA7 | P43166 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | DRD2 | P14416 | 1/20 | 0.32 |
| ▸ | DRD1 | P21728 | 1/20 | 0.32 |
| ▸ | DRD4 | P21917 | 1/20 | 0.32 |
| ▸ | DRD5 | P21918 | 1/20 | 0.32 |
| ▸ | DRD3 | P35462 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL27633952 | 0.88 | HTT (0.39) | HTR6HTTHRH4ALDH1A1TSHR | |
| SCHEMBL29077706 | 0.78 | MAOB (0.42) | CA2CA1CA9CA12DRD2 | |
| SCHEMBL2491524 | 0.77 | CA2 (0.40) | CA2CA1CA9ALDH1A1CA12 | |
| SCHEMBL6506817 | 0.77 | MAPT (0.40) | CA2HTTALDH1A1TSHRSMN1; SMN2 | |
| SCHEMBL7067658 | 0.76 | ALDH1A1 (0.41) | CA2HTR6HTTCA1CA9 | |
| SCHEMBL1707826 | 0.76 | LMNA (0.39) | CA2HTTCA1CA9ALDH1A1 | |
| SCHEMBL29000527 | 0.75 | CA2 (0.41) | CA2CA1CA9ALDH1A1TSHR | |
| SCHEMBL4602235 | 0.75 | TAS1R3 (0.36) | CA2HTTCA1CA9ALDH1A1 | |
| SCHEMBL28222876 | 0.75 | CA2 (0.36) | CA2CA1CA9CA12CA7 | |
| SCHEMBL29104732 | 0.74 | CA1 (0.41) | CA2HTTCA1ALDH1A1CA12 |
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 |
|---|---|---|---|---|---|---|---|
| CN-116332873-A | Protein tyrosine phosphatase inhibitors and methods of use thereof | 卡里科生命科学有限责任公司 | 2023-06-27 | — | — | CN | disclosed |