Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSL | P07711 | 13/20 | 0.33 |
| ▸ | CTSS | P25774 | 12/20 | 0.33 |
| ▸ | CTSV | O60911 | 4/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | CTSK | P43235 | 14/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | CTSB | P07858 | 3/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 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 | |
|---|---|---|---|---|
| SCHEMBL4042095 | 0.93 | CTSK (0.39) | CTSLCTSSCTSVNPC1RAB9A | |
| SCHEMBL4040800 | 0.92 | PREP (0.36) | CTSLCTSSCTSVNPC1RAB9A | |
| SCHEMBL4046671 | 0.90 | CTSK (0.41) | CTSLCTSSCTSVCTSKCTSB | |
| SCHEMBL4045248 | 0.89 | NPC1 (0.33) | CTSLCTSSCTSVNPC1RAB9A | |
| SCHEMBL4049249 | 0.89 | CHRNB2 (0.36) | CTSLCTSSCTSVSMN1; SMN2TSHR | |
| SCHEMBL4041817 | 0.88 | CTSL (0.33) | CTSLCTSSCTSVCTSKCTSB | |
| SCHEMBL4042558 | 0.85 | CTSK (0.39) | CTSLCTSSCTSVNPC1RAB9A | |
| SCHEMBL4040779 | 0.83 | CTSV (0.34) | CTSLCTSSCTSVSMN1; SMN2CTSK | |
| SCHEMBL4042994 | 0.83 | CTSS (0.35) | CTSLCTSSCTSVCTSKGAA | |
| SCHEMBL4048016 | 0.83 | CTSK (0.46) | CTSLCTSSCTSVCTSKCTSB |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2086958-A2 | SUBSTITUTED-QUINOXALINE-TYPE-PIPERIDINE COMPOUNDS AND THE USES THEREOF | Purdue Pharma LP (US) | 2009-08-12 | — | — | EP | disclosed |
| WO-2009027820-A2 | SUBSTITUTED-QUINOXALINE-TYPE-PIPERIDINE COMPOUNDS AND THE USES THEREOF | PURDUE PHARMA L.P. (DE) | 2009-03-05 | — | — | WO | disclosed |