Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSK | P43235 | 4/20 | 0.54 |
| ▸ | CTSS | P25774 | 3/20 | 0.54 |
| ▸ | AAK1 | Q2M2I8 | 2/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.39 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.39 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | REN | P00797 | 1/20 | 0.37 |
| ▸ | CACNA1B | Q00975 | 4/20 | 0.36 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.35 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.35 |
| ▸ | RELA | Q04206 | 1/20 | 0.35 |
| ▸ | CA1 | P00915 | 1/20 | 0.35 |
| ▸ | CA2 | P00918 | 1/20 | 0.35 |
| ▸ | CA7 | P43166 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL9833210 | 1.00 | CTSK (0.54) | CTSKCTSSAAK1KMT2AHDAC4 | |
| SCHEMBL7326977 | 0.88 | CTSK (0.61) | CTSKCTSSAAK1HDAC4HDAC1 | |
| SCHEMBL12632054 | 0.85 | CTSS (0.57) | CTSKCTSSAAK1KMT2AHDAC4 | |
| SCHEMBL1864392 | 0.84 | CTSS (0.62) | CTSKCTSSAAK1KMT2A | |
| SCHEMBL1864395 | 0.84 | CTSS (0.62) | CTSKCTSSAAK1KMT2A | |
| SCHEMBL3616008 | 0.82 | CTSS (0.63) | CTSKCTSSAAK1KMT2AHDAC4 | |
| SCHEMBL3616006 | 0.82 | CTSS (0.63) | CTSKCTSSAAK1KMT2AHDAC4 | |
| SCHEMBL7084925 | 0.79 | CTSS (0.63) | CTSKCTSSAAK1KMT2AHDAC4 | |
| SCHEMBL14151599 | 0.79 | CTSS (0.63) | CTSKCTSSAAK1KMT2AHDAC4 | |
| SCHEMBL6078092 | 0.79 | CTSS (0.63) | CTSKCTSSAAK1KMT2AHDAC4 |
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-0300287-B1 | PROCESS FOR THE REDUCTION OF KETONES | MERCK PATENT GmbH (DE) | 1993-01-07 | — | — | EP | disclosed |
| US-5026642-A | Process for the enzymatic production of ketones | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1991-06-25 | — | — | US | disclosed |