Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALOX5 | P09917 | 1/20 | 0.61 |
| ▸ | ACHE | P22303 | 2/20 | 0.48 |
| ▸ | NPC1 | O15118 | 2/20 | 0.48 |
| ▸ | RAB9A | P51151 | 2/20 | 0.48 |
| ▸ | MEN1 | O00255 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.48 |
| ▸ | PPARG | P37231 | 1/20 | 0.48 |
| ▸ | MRGPRX4 | Q96LA9 | 1/20 | 0.45 |
| ▸ | LCK | P06239 | 1/20 | 0.44 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.44 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.44 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.44 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.44 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL1041386 | 0.88 | ALOX5 (0.61) | ALOX5NPC1RAB9AMEN1KMT2A | |
| SCHEMBL23453280 | 0.80 | KDM4E (0.59) | ACHENPC1RAB9APPARG | |
| SCHEMBL6353536 | 0.78 | NPC1 (0.53) | ACHENPC1RAB9APPARG | |
| SCHEMBL51460 | 0.77 | ALOX5 (1.00) | ALOX5NPC1RAB9AMEN1KMT2A | |
| SCHEMBL14330631 | 0.77 | CYP2C9 (0.43) | ACHENPC1RAB9APPARGCYP1A2 | |
| SCHEMBL28662350 | 0.76 | ALOX5 (0.89) | ALOX5NPC1RAB9AMEN1KMT2A | |
| SCHEMBL23412203 | 0.75 | KDM4E (0.57) | ACHENPC1RAB9A | |
| SCHEMBL6999744 | 0.75 | ALOX5 (0.68) | ALOX5NPC1RAB9AMEN1KMT2A | |
| SCHEMBL1289697 | 0.74 | ACHE (0.67) | ACHENPC1RAB9AMEN1KMT2A | |
| SCHEMBL4980048 | 0.74 | KMT2A (0.51) | NPC1RAB9AMEN1KMT2ALMNA |
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 |
|---|---|---|---|---|---|---|---|
| WO-2020063854-A1 | QUINOLINE-BASED DERIVATIVES AS VAP-1 INHIBITORS | 南京明德新药研发有限公司 | 2020-04-02 | — | — | WO | disclosed |
| EP-2029572-B1 | ORGANIC COMPOUNDS | NOVARTIS AG (CH) | 2010-11-03 | — | — | EP | disclosed |