Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNB2 | P17787 | 1/20 | 0.36 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.36 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 2/20 | 0.35 |
| ▸ | SMYD3 | Q9H7B4 | 2/20 | 0.34 |
| ▸ | USP2 | O75604 | 3/20 | 0.33 |
| ▸ | LMNA | P02545 | 3/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 2/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | FKBP1A | P62942 | 1/20 | 0.33 |
| ▸ | CTSV | O60911 | 2/20 | 0.32 |
| ▸ | CTSL | P07711 | 2/20 | 0.32 |
| ▸ | CTSS | P25774 | 2/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL4044165 | 0.93 | CTSK (0.38) | CHRNB2CHRNA7CHRNA4GAASMYD3 | |
| SCHEMBL4048128 | 0.92 | CHRNB2 (0.36) | CHRNB2CHRNA7CHRNA4GAASMYD3 | |
| SCHEMBL4046215 | 0.90 | CHRNB2 (0.34) | CHRNB2CHRNA7CHRNA4GAASMYD3 | |
| SCHEMBL4042994 | 0.89 | CTSS (0.35) | CHRNB2CHRNA7CHRNA4GAACTSV | |
| SCHEMBL4047097 | 0.89 | CTSL (0.33) | GAASMN1; SMN2TSHRCTSVCTSL | |
| SCHEMBL4041842 | 0.88 | CHRNB2 (0.37) | CHRNB2CHRNA7CHRNA4GAAUSP2 | |
| SCHEMBL4046671 | 0.85 | CTSK (0.41) | CTSVCTSLCTSS | |
| SCHEMBL4041817 | 0.83 | CTSL (0.33) | CTSVCTSLCTSS | |
| SCHEMBL4039790 | 0.83 | CTSK (0.39) | CHRNB2CHRNA7CHRNA4GAAUSP2 | |
| SCHEMBL4042714 | 0.83 | SMN1; SMN2 (0.36) | CHRNB2CHRNA7CHRNA4GAAUSP2 |
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 |