Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMYD3 | Q9H7B4 | 2/20 | 0.34 |
| ▸ | CTSK | P43235 | 3/20 | 0.34 |
| ▸ | FKBP1A | P62942 | 1/20 | 0.33 |
| ▸ | CTSS | P25774 | 2/20 | 0.32 |
| ▸ | CTSB | P07858 | 1/20 | 0.32 |
| ▸ | PTGER2 | P43116 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | CTSL | P07711 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | F2 | P00734 | 1/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL4052140 | 0.90 | HSD17B10 (0.36) | SMYD3CTSKKMT2AALDH1A1TSHR | |
| SCHEMBL4044172 | 0.90 | CTSS (0.36) | CTSKFKBP1ACTSSCTSBCTSL | |
| SCHEMBL4051458 | 0.89 | CTSK (0.36) | CTSK | |
| SCHEMBL4041626 | 0.88 | CTSK (0.34) | CTSKCTSSKMT2ACTSLALDH1A1 | |
| SCHEMBL4051346 | 0.88 | CTSK (0.38) | CTSKCTSSCTSBPTGER2KMT2A | |
| SCHEMBL4047237 | 0.86 | SMYD3 (0.35) | SMYD3CTSKFKBP1ACTSSCTSL | |
| SCHEMBL4044148 | 0.85 | CTSK (0.42) | CTSKCTSSCTSBCTSL | |
| SCHEMBL4046569 | 0.84 | CTSK (0.35) | CTSKCTSSCTSL | |
| SCHEMBL4049268 | 0.83 | SMYD3 (0.35) | SMYD3CTSKFKBP1ACTSSCTSL | |
| SCHEMBL4046591 | 0.82 | CTSK (0.35) | CTSKKMT2A |
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-1546150-B1 | PYRROLE DERIVATIVES AS INHIBITORS OF CYTEINE PROTEASES | AMURA THERAPEUTICS LTD (GB) | 2009-03-04 | — | — | EP | claimed |