Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSL | P07711 | 7/20 | 0.49 |
| ▸ | CTSK | P43235 | 4/20 | 0.44 |
| ▸ | CTSB | P07858 | 3/20 | 0.44 |
| ▸ | CTSS | P25774 | 3/20 | 0.44 |
| ▸ | MAOB | P27338 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 5/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.42 |
| ▸ | USP2 | O75604 | 3/20 | 0.41 |
| ▸ | HDAC1 | Q13547 | 3/20 | 0.41 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | HIF1A | Q16665 | 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 | |
|---|---|---|---|---|
| SCHEMBL19029710 | 0.78 | CTSL (0.73) | CTSLCTSKCTSBCTSSALDH1A1 | |
| SCHEMBL4841029 | 0.77 | NPSR1 (0.45) | CYP3A4CYP2D6CYP2C9CYP2C19USP2 | |
| SCHEMBL4837814 | 0.76 | NPSR1 (0.44) | CYP3A4CYP2D6CYP2C9CYP2C19USP2 | |
| SCHEMBL8055885 | 0.75 | CTSL (0.74) | CTSLCTSKCTSBCTSSALDH1A1 | |
| SCHEMBL5236409 | 0.73 | NPSR1 (0.42) | CYP3A4CYP2D6CYP2C9CYP2C19USP2 | |
| SCHEMBL1488545 | 0.72 | NPSR1 (0.41) | CTSLCYP3A4CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL29642581 | 0.71 | CTSL (0.60) | CTSLCTSKCTSBCTSS | |
| SCHEMBL5527398 | 0.71 | OPRL1 (0.49) | CYP3A4CYP2D6CYP2C9USP2CYP1A2 | |
| SCHEMBL9233452 | 0.71 | CTSL (0.56) | CTSLCTSKCTSBCTSSALDH1A1 | |
| SCHEMBL9231743 | 0.71 | OPRD1 (0.44) | CTSLCTSKMAOBCYP3A4CYP2D6 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0677522-A1 | 8-METHOXYQUINOLONECARBOXYLIC ACID DERIVATIVE | YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) | 1995-10-18 | — | — | EP | disclosed |