Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 2/20 | 0.40 |
| ▸ | CA7 | P43166 | 2/20 | 0.40 |
| ▸ | CA12 | O43570 | 1/20 | 0.40 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.40 |
| ▸ | CTSK | P43235 | 8/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.34 |
| ▸ | CA2 | P00918 | 1/20 | 0.34 |
| ▸ | MAOA | P21397 | 1/20 | 0.34 |
| ▸ | MAOB | P27338 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | MIF | P14174 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | RECQL | P46063 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL293062 | 0.78 | CTSK (0.40) | CA1CA7CA12CA14CTSK | |
| SCHEMBL9924135 | 0.78 | CA12 (0.40) | CA1CA7CA12CA14CTSK | |
| SCHEMBL10883543 | 0.77 | CTSK (0.39) | CA1CA7CA12CA14CTSK | |
| SCHEMBL1370948 | 0.76 | TDP1 (0.38) | CA1CA7CA12CA14CTSK | |
| SCHEMBL12691730 | 0.75 | CA1 (0.42) | CA1CA7CA12CA14CTSK | |
| SCHEMBL23222938 | 0.74 | APLNR (0.38) | CA1CA7CA12CA14TDP1 | |
| SCHEMBL8353864 | 0.74 | APLNR (0.38) | CA1CA7CA12CA14CTSK | |
| SCHEMBL13827739 | 0.74 | TDP1 (0.37) | CA1CA7CA12CA14TDP1 | |
| SCHEMBL28824278 | 0.73 | CTSK (0.37) | CA1CA7CTSKTDP1DGAT1 | |
| SCHEMBL186200 | 0.73 | DGAT1 (0.42) | CA1CA7CA12CA14CTSK |
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 |
|---|---|---|---|---|---|---|---|
| WO-2012000608-A2 | NOVEL BETA-AMINOALDEHYDE DERIVATIVES, PROCESS FOR THEIR PREPARATION AND THEIR CHEMICAL USE AS REACTIVE INTERMEDIATES | GLUESENKAMP KARL-HEINZ (DE) | 2012-01-05 | — | — | WO | disclosed |