Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 2/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | SLC1A2 | P43004 | 2/20 | 0.41 |
| ▸ | SLC1A1 | P43005 | 2/20 | 0.41 |
| ▸ | SLC1A3 | P43003 | 1/20 | 0.41 |
| ▸ | PPARG | P37231 | 3/20 | 0.39 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.39 |
| ▸ | AKR1A1 | P14550 | 1/20 | 0.39 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.39 |
| ▸ | HTR2A | P28223 | 1/20 | 0.39 |
| ▸ | HTR2C | P28335 | 1/20 | 0.39 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.39 |
| ▸ | HRH1 | P35367 | 1/20 | 0.39 |
| ▸ | DRD3 | P35462 | 1/20 | 0.39 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.39 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.39 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | GRIK1 | P39086 | 2/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL28293495 | 0.98 | CA2 (0.47) | CA2MAPK1SMN1; SMN2SLC1A2SLC1A1 | |
| 2-Ethylhexanoic Acid SCHEMBL11328410 | 0.81 | CA2 (0.61) | CA2MAPK1SMN1; SMN2SLC1A2SLC1A1 | |
| SCHEMBL20854669 | 0.77 | CA2 (0.50) | CA2MAPK1SMN1; SMN2SLC1A2SLC1A1 | |
| SCHEMBL14159145 | 0.77 | ADH1A (0.44) | SMN1; SMN2ADH1ANAAA | |
| SCHEMBL5253542 | 0.77 | ADH1A (0.44) | SMN1; SMN2ADH1ANAAA | |
| SCHEMBL8590668 | 0.76 | CA2 (0.61) | CA2MAPK1SLC1A2SLC1A1SLC1A3 | |
| SCHEMBL3151682 | 0.75 | PPARG (0.53) | CA2MAPK1SMN1; SMN2SLC1A2SLC1A1 | |
| SCHEMBL24437852 | 0.75 | ADH1A (0.42) | ADH1ANAAA | |
| SCHEMBL15375241 | 0.75 | ADH1A (0.42) | ADH1ANAAA | |
| SCHEMBL24437739 | 0.75 | ADH1A (0.42) | ADH1ANAAA |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-110123820-A | Arginase inhibitor and its application method | 阿斯利康公司 | 2019-08-16 | — | — | CN | disclosed |
| CN-104857005-B | Arginase inhibitor and its application method | 阿斯利康公司 | 2019-04-26 | — | — | CN | disclosed |