Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 1/20 | 0.45 |
| ▸ | CA2 | P00918 | 1/20 | 0.45 |
| ▸ | CA5A | P35218 | 1/20 | 0.45 |
| ▸ | CA9 | Q16790 | 1/20 | 0.45 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.32 |
| ▸ | OGG1 | O15527 | 1/20 | 0.30 |
| ▸ | EPM2A | O95278 | 1/20 | 0.30 |
| ▸ | PTPN2 | P17706 | 1/20 | 0.30 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.30 |
| ▸ | PTPN22 | Q9Y2R2 | 1/20 | 0.30 |
| ▸ | KDM4E | B2RXH2 | 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 | |
|---|---|---|---|---|
| SCHEMBL3349106 | 0.73 | CA1 (0.41) | CA1CA2CA5ACA9CYP2A6 | |
| SCHEMBL19191222 | 0.73 | CA1 (0.45) | CA1CA2CA5ACA9CYP2A6 | |
| SCHEMBL3979356 | 0.71 | CYP2A6 (0.40) | CA1CA2CA5ACA9CYP2A6 | |
| SCHEMBL1025732 | 0.71 | CYP2A6 (0.40) | CA1CA2CA5ACA9CYP2A6 | |
| SCHEMBL3671873 | 0.70 | ESR1 (0.56) | CA1CA2CA5ACA9CYP2A6 | |
| SCHEMBL5362456 | 0.70 | CA1 (0.46) | CA1CA2CA5ACA9CYP2A6 | |
| SCHEMBL3682657 | 0.70 | CA1 (0.46) | CA1CA2CA5ACA9CYP2A6 | |
| SCHEMBL663302 | 0.70 | CA1 (0.46) | CA1CA2CA5ACA9CYP2A6 | |
| SCHEMBL28769526 | 0.70 | CA1 (0.42) | CA1CA2CA5ACA9CYP2A6 | |
| SCHEMBL28769525 | 0.70 | CA1 (0.42) | CA1CA2CA5ACA9CYP2A6 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2446026-A1 | TRANSAMINASE REACTIONS | Codexis, Inc. (US) | 2012-05-02 | — | — | EP | disclosed |
| WO-2011005477-A1 | TRANSAMINASE REACTIONS | CODEXIS, INC. (US) | 2011-01-13 | — | — | WO | disclosed |