Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 5/20 | 0.60 |
| ▸ | CA1 | P00915 | 5/20 | 0.60 |
| ▸ | CA2 | P00918 | 5/20 | 0.60 |
| ▸ | CA9 | Q16790 | 5/20 | 0.60 |
| ▸ | ITGB3 | P05106 | 2/20 | 0.58 |
| ▸ | ITGA2B | P08514 | 2/20 | 0.58 |
| ▸ | SUCNR1 | Q9BXA5 | 6/20 | 0.51 |
| ▸ | SLC7A5 | Q01650 | 2/20 | 0.48 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.46 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.45 |
| ▸ | IDO1 | P14902 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL28577195 | 1.00 | CA12 (0.60) | CA12CA1CA2CA9ITGB3 | |
| SCHEMBL7315183 | 0.92 | CA12 (0.62) | CA12CA1CA2CA9ITGB3 | |
| SCHEMBL30149840 | 0.91 | CA12 (0.60) | CA12CA1CA2CA9ITGB3 | |
| SCHEMBL27429007 | 0.89 | CA12 (0.59) | CA12CA1CA2CA9ITGB3 | |
| SCHEMBL27433821 | 0.89 | CA12 (0.59) | CA12CA1CA2CA9ITGB3 | |
| SCHEMBL21602848 | 0.87 | CA12 (0.57) | CA12CA1CA2CA9ITGB3 | |
| SCHEMBL21544628 | 0.87 | ITGB3 (0.59) | CA12CA1CA2CA9ITGB3 | |
| SCHEMBL22046128 | 0.85 | CA12 (0.62) | CA12CA1CA2CA9ITGB3 | |
| SCHEMBL21644787 | 0.85 | ITGB3 (0.63) | CA12CA1CA2CA9ITGB3 | |
| SCHEMBL21644790 | 0.85 | ITGB3 (0.63) | CA12CA1CA2CA9ITGB3 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2011075678-A1 | SPECIFIC INHIBITORS AND ACTIVE SITE PROBES FOR LEGUMAIN | THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY (US) | 2011-06-23 | — | — | WO | claimed |
| CN-112920086-B | Preparation method of L-tyrosine derivative | 长兴宜生药物科技有限公司 | 2023-01-24 | — | — | CN | disclosed |
| CN-112920086-A | Preparation method of L-tyrosine derivative | 长兴中昊化工有限公司 | 2021-06-08 | — | — | CN | disclosed |
| WO-2011075678-A1 | SPECIFIC INHIBITORS AND ACTIVE SITE PROBES FOR LEGUMAIN | THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY (US) | 2011-06-23 | — | — | WO | disclosed |