Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 7/20 | 0.63 |
| ▸ | CA1 | P00915 | 4/20 | 0.63 |
| ▸ | PTPN1 | P18031 | 2/20 | 0.58 |
| ▸ | CTSL | P07711 | 1/20 | 0.56 |
| ▸ | NPC1 | O15118 | 1/20 | 0.54 |
| ▸ | RAB9A | P51151 | 1/20 | 0.54 |
| ▸ | MEN1 | O00255 | 2/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.53 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.53 |
| ▸ | ACE | P12821 | 2/20 | 0.53 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.53 |
| ▸ | ITGA2B | P08514 | 1/20 | 0.53 |
| ▸ | CA12 | O43570 | 1/20 | 0.53 |
| ▸ | CA9 | Q16790 | 1/20 | 0.53 |
| ▸ | LNPEP | Q9UIQ6 | 1/20 | 0.52 |
| ▸ | GRIA1 | P42261 | 1/20 | 0.52 |
| ▸ | MME | P08473 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL11269522 | 0.92 | CA2 (0.72) | CA2CA1PTPN1CTSLNPC1 | |
| SCHEMBL11278740 | 0.92 | CA2 (0.72) | CA2CA1PTPN1CTSLNPC1 | |
| SCHEMBL7363606 | 0.90 | CA2 (0.71) | CA2CA1PTPN1CTSLMEN1 | |
| SCHEMBL5793343 | 0.88 | CA2 (0.69) | CA2CA1PTPN1CTSLACE | |
| SCHEMBL3404637 | 0.88 | CA2 (0.69) | CA2CA1PTPN1CTSLACE | |
| SCHEMBL8667639 | 0.88 | CA2 (0.69) | CA2CA1PTPN1CTSLACE | |
| Bentiromide SCHEMBL9008617 | 0.88 | CTSL (0.56) | CA2CA1CTSLNPC1RAB9A | |
| SCHEMBL7442291 | 0.87 | CA2 (0.71) | CA2CA1PTPN1NPC1RAB9A | |
| SCHEMBL7442309 | 0.87 | CA2 (0.71) | CA2CA1PTPN1NPC1RAB9A | |
| SCHEMBL8520566 | 0.86 | PTPN1 (0.72) | CA2CA1PTPN1CTSLMEN1 |
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-114880879-A | Training method and system for pancreatic exocrine function evaluation model, electronic device and medium | 中国人民解放军海军军医大学第一附属医院 | 2022-08-09 | — | — | CN | disclosed |