Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGB3 | P05106 | 1/20 | 0.37 |
| ▸ | ITGAV | P06756 | 1/20 | 0.37 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.35 |
| ▸ | CTSK | P43235 | 3/20 | 0.35 |
| ▸ | ITGA4 | P13612 | 6/20 | 0.35 |
| ▸ | ITGB7 | P26010 | 5/20 | 0.35 |
| ▸ | ITGB1 | P05556 | 2/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.34 |
| ▸ | MMP1 | P03956 | 1/20 | 0.34 |
| ▸ | MMP9 | P14780 | 1/20 | 0.34 |
| ▸ | MMP13 | P45452 | 1/20 | 0.34 |
| ▸ | ADAM17 | P78536 | 1/20 | 0.34 |
| ▸ | BCL2 | P10415 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL4047239 | 0.94 | CTSK (0.34) | CTSKP2RX7 | |
| SCHEMBL4047305 | 0.93 | P2RX7 (0.37) | CTSKITGA4ITGB7ITGB1P2RX7 | |
| SCHEMBL4041712 | 0.90 | ITGA4 (0.40) | ITGB3ITGAVHDAC8CTSKITGA4 | |
| SCHEMBL4047763 | 0.89 | CTSK (0.44) | CTSKKMT2A | |
| SCHEMBL4047214 | 0.89 | CTSK (0.33) | ITGB3ITGAVCTSKITGA4ITGB1 | |
| SCHEMBL4041133 | 0.89 | CTSK (0.36) | CTSK | |
| SCHEMBL4039714 | 0.86 | CTSK (0.51) | CTSKKMT2ACA2 | |
| SCHEMBL4046036 | 0.84 | P2RX7 (0.36) | CTSKITGA4ITGB7ITGB1P2RX7 | |
| SCHEMBL6234334 | 0.84 | CTSK (0.44) | ITGB3CTSKITGA4ITGB1KMT2A | |
| SCHEMBL4041901 | 0.83 | P2RX7 (0.39) | CTSKITGA4ITGB7ITGB1P2RX7 |
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 |