Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSK | P43235 | 5/20 | 0.62 |
| ▸ | CTSS | P25774 | 2/20 | 0.62 |
| ▸ | AAK1 | Q2M2I8 | 2/20 | 0.49 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.46 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.46 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.46 |
| ▸ | REN | P00797 | 2/20 | 0.42 |
| ▸ | CACNA1B | Q00975 | 4/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.40 |
| ▸ | CTSL | P07711 | 1/20 | 0.40 |
| ▸ | CTSB | P07858 | 1/20 | 0.40 |
| ▸ | CTSH | P09668 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 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 | |
|---|---|---|---|---|
| SCHEMBL3610659 | 0.88 | CTSK (0.64) | CTSKCTSSAAK1HDAC4HDAC1 | |
| SCHEMBL3610662 | 0.88 | CTSK (0.64) | CTSKCTSSAAK1HDAC4HDAC1 | |
| SCHEMBL970373 | 0.86 | CTSK (0.62) | CTSKCTSSAAK1HDAC4HDAC1 | |
| SCHEMBL970372 | 0.86 | CTSK (0.62) | CTSKCTSSAAK1HDAC4HDAC1 | |
| SCHEMBL10536248 | 0.86 | CTSK (0.66) | CTSKCTSSAAK1HDAC4HDAC1 | |
| SCHEMBL16119378 | 0.86 | CTSK (0.62) | CTSKCTSSAAK1HDAC4HDAC1 | |
| SCHEMBL7326977 | 0.85 | CTSK (0.61) | CTSKCTSSAAK1HDAC4HDAC1 | |
| SCHEMBL21427220 | 0.85 | CTSK (0.70) | CTSKCTSSAAK1HDAC4HDAC1 | |
| SCHEMBL21427213 | 0.85 | CTSK (0.70) | CTSKCTSSAAK1HDAC4HDAC1 | |
| SCHEMBL16946 | 0.85 | CTSK (0.70) | CTSKCTSSAAK1HDAC4HDAC1 |
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-0309841-A2 | Amino acid derivatives | MERCK PATENT GmbH (DE) | 1989-04-05 | — | — | EP | disclosed |
| EP-0264795-A2 | Amino acid derivatives | MERCK PATENT GmbH (DE) | 1988-04-27 | — | — | EP | disclosed |