Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 1/20 | 0.46 |
| ▸ | CA2 | P00918 | 1/20 | 0.46 |
| ▸ | CA7 | P43166 | 1/20 | 0.46 |
| ▸ | CTSK | P43235 | 3/20 | 0.45 |
| ▸ | CTSL | P07711 | 2/20 | 0.45 |
| ▸ | CTSS | P25774 | 2/20 | 0.45 |
| ▸ | CTSB | P07858 | 1/20 | 0.45 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | CAPN1 | P07384 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL13617288 | 1.00 | CA1 (0.46) | CA1CA2CA7CTSKCTSL | |
| SCHEMBL6791378 | 1.00 | CA1 (0.46) | CA1CA2CA7CTSKCTSL | |
| SCHEMBL28953786 | 1.00 | CA1 (0.46) | CA1CA2CA7CTSKCTSL | |
| SCHEMBL3469151 | 1.00 | CA1 (0.46) | CA1CA2CA7CTSKCTSL | |
| SCHEMBL8270799 | 1.00 | CA1 (0.46) | CA1CA2CA7CTSKCTSL | |
| SCHEMBL21012512 | 0.86 | CA1 (0.39) | CA1CA2CA7CTSKCTSL | |
| SCHEMBL11025437 | 0.84 | CA1 (0.41) | CA1CA2CA7CTSKCTSS | |
| SCHEMBL590056 | 0.84 | CTSK (0.42) | CA1CA2CA7CTSKCTSS | |
| SCHEMBL3327360 | 0.82 | CA1 (0.40) | CA1CA2CA7CTSKCTSS | |
| SCHEMBL28848464 | 0.81 | CTSK (0.50) | CA1CA2CA7CTSKCTSS |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114957053-B | Oxoethylene compound or pharmaceutically acceptable salt thereof, preparation method and application thereof, pharmaceutical composition and application thereof | 中国医学科学院医药生物技术研究所 | 2023-12-22 | — | — | CN | disclosed |
| CN-114957053-A | Oxoethylene compound or pharmaceutically acceptable salt thereof, preparation method and application thereof, pharmaceutical composition and application thereof | 中国医学科学院医药生物技术研究所 | 2022-08-30 | — | — | CN | disclosed |
| US-7585938-B2 | Gamma-secretase inhibitors | MORI HIROSHI | 2009-09-08 | — | — | US | disclosed |