Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 1/20 | 0.45 |
| ▸ | CA2 | P00918 | 1/20 | 0.45 |
| ▸ | CA7 | P43166 | 1/20 | 0.45 |
| ▸ | CTSK | P43235 | 4/20 | 0.43 |
| ▸ | ITGB3 | P05106 | 8/20 | 0.42 |
| ▸ | ITGA2B | P08514 | 8/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | CPB2 | Q96IY4 | 2/20 | 0.40 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.40 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.40 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.40 |
| ▸ | CTSS | P25774 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL4382302 | 0.98 | CA1 (0.46) | CA1CA2CA7CTSKITGB3 | |
| SCHEMBL25320847 | 0.93 | CA1 (0.47) | CA1CA2CA7CTSKCYP2D6 | |
| SCHEMBL25320849 | 0.93 | CA1 (0.47) | CA1CA2CA7CTSKCYP2D6 | |
| SCHEMBL86310 | 0.86 | CA1 (0.50) | CA1CA2CA7CTSKCYP2D6 | |
| SCHEMBL1654201 | 0.86 | CA1 (0.50) | CA1CA2CA7CTSKCYP2D6 | |
| SCHEMBL86237 | 0.86 | CA1 (0.50) | CA1CA2CA7CTSKCYP2D6 | |
| SCHEMBL2488917 | 0.85 | TDP1 (0.56) | CA1CA2CA7CTSKCYP2D6 | |
| SCHEMBL28599705 | 0.85 | CTSK (0.55) | CA1CA2CA7CTSKCTSS | |
| SCHEMBL4781261 | 0.85 | CTSK (0.55) | CA1CA2CA7CTSKCTSS | |
| SCHEMBL30464946 | 0.85 | CTSK (0.55) | 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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0400290-A1 | 5-Amino-4-hydroxyvalerianic acid derivatives useful as intermediates in the preparation of renin inhibitors | CIBA-GEIGY AG (CH) | 1990-12-05 | — | — | EP | disclosed |
| EP-0144290-A2 | Substituted ethylenediamine derivatives | CIBA-GEIGY AG (CH) | 1985-06-12 | — | — | EP | disclosed |