Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 2/20 | 0.40 |
| ▸ | CA2 | P00918 | 2/20 | 0.40 |
| ▸ | ACHE | P22303 | 2/20 | 0.40 |
| ▸ | CTSK | P43235 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | CTSL | P07711 | 1/20 | 0.35 |
| ▸ | CTSS | P25774 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.35 |
| ▸ | ITGA2B | P08514 | 1/20 | 0.35 |
| ▸ | CASP1 | P29466 | 1/20 | 0.35 |
| ▸ | SYK | P43405 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL25339346 | 0.92 | TAOK1 (0.35) | CA1CA2ACHE | |
| SCHEMBL28934875 | 0.81 | CA1 (0.56) | CA1CA2ACHECTSKCTSL | |
| SCHEMBL29132486 | 0.76 | KEAP1 (0.41) | CA1CA2ACHELMNASMN1; SMN2 | |
| SCHEMBL22412174 | 0.76 | CA1 (0.44) | CA1CA2ACHECYP1A2 | |
| SCHEMBL30683967 | 0.76 | PTGIR (0.38) | CA1CA2ACHELMNAITGB3 | |
| SCHEMBL29132508 | 0.76 | PTGIR (0.38) | CA1CA2ACHELMNAITGB3 | |
| SCHEMBL29132482 | 0.75 | CA1 (0.46) | CA1CA2ACHE | |
| SCHEMBL25338586 | 0.74 | ITGB3 (0.43) | ITGB3ITGA2B | |
| SCHEMBL29132505 | 0.74 | HTR2A (0.38) | CA1CA2ACHE | |
| SCHEMBL25338513 | 0.74 | BRD4 (0.37) | CA1CA2ACHELMNA |
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-116829555-A | Protein tyrosine phosphatase inhibitors and methods of use thereof | 卡里科生命科学有限责任公司 | 2023-09-29 | — | — | CN | disclosed |