Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSK | P43235 | 10/20 | 0.40 |
| ▸ | CTSS | P25774 | 6/20 | 0.40 |
| ▸ | CTSL | P07711 | 2/20 | 0.40 |
| ▸ | CTSB | P07858 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | PPARA | Q07869 | 2/20 | 0.38 |
| ▸ | CA1 | P00915 | 1/20 | 0.38 |
| ▸ | CA2 | P00918 | 1/20 | 0.38 |
| ▸ | CA7 | P43166 | 1/20 | 0.38 |
| ▸ | PPARG | P37231 | 1/20 | 0.37 |
| ▸ | CAPN1 | P07384 | 1/20 | 0.36 |
| ▸ | KLK7 | P49862 | 1/20 | 0.35 |
| ▸ | KLK5 | Q9Y337 | 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 | |
|---|---|---|---|---|
| SCHEMBL3617062 | 0.90 | CTSK (0.41) | CTSKCTSSCTSLCTSBCYP1A2 | |
| SCHEMBL4745237 | 0.90 | CTSK (0.41) | CTSKCTSSCTSLCTSBCYP1A2 | |
| SCHEMBL3617063 | 0.90 | CTSK (0.41) | CTSKCTSSCTSLCTSBCYP1A2 | |
| SCHEMBL4388129 | 0.88 | PPARA (0.48) | CTSKCTSSCTSLCTSBPPARA | |
| SCHEMBL7991202 | 0.88 | PPARA (0.48) | CTSKCTSSCTSLCTSBPPARA | |
| SCHEMBL15129729 | 0.88 | PPARA (0.48) | CTSKCTSSCTSLCTSBPPARA | |
| SCHEMBL19661550 | 0.85 | CYP1A2 (0.42) | CTSKCTSSCTSLCTSBCYP1A2 | |
| SCHEMBL18104869 | 0.84 | CTSK (0.40) | CTSKCTSSCTSLCTSBCYP1A2 | |
| SCHEMBL16553015 | 0.83 | CTSK (0.39) | CTSKCTSSCTSLCTSBCYP1A2 | |
| SCHEMBL16553016 | 0.83 | CTSK (0.39) | CTSKCTSSCTSLCTSBCYP1A2 |
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 |
|---|---|---|---|---|---|---|---|
| US-5137884-A | Antibiotics | MERCK & CO., INC. (US) | 1992-08-11 | — | — | US | disclosed |