Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CFTR | P13569 | 4/20 | 0.66 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.45 |
| ▸ | HPGD | P15428 | 2/20 | 0.45 |
| ▸ | LMNA | P02545 | 1/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.45 |
| ▸ | NOD1 | Q9Y239 | 1/20 | 0.45 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.44 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL29847411 | 0.91 | CFTR (0.78) | CFTRKDM4EALDH1A1HPGDLMNA | |
| SCHEMBL982666 | 0.91 | CFTR (0.58) | CFTRKDM4EALDH1A1HPGDLMNA | |
| SCHEMBL981277 | 0.91 | CFTR (0.78) | CFTRKDM4EALDH1A1HPGDLMNA | |
| SCHEMBL3441312 | 0.87 | CFTR (0.71) | CFTRKDM4EALDH1A1HPGDLMNA | |
| SCHEMBL19032847 | 0.80 | CFTR (1.00) | CFTRALDH1A1LMNA | |
| SCHEMBL982445 | 0.79 | CFTR (0.74) | CFTRKDM4EALDH1A1HPGDGAA | |
| SCHEMBL981286 | 0.78 | CFTR (0.60) | CFTRKDM4EALDH1A1HPGDLMNA | |
| SCHEMBL981951 | 0.76 | CFTR (0.62) | CFTRKDM4EALDH1A1HPGDLMNA | |
| SCHEMBL31448338 | 0.76 | CFTR (0.62) | CFTRKDM4EALDH1A1HPGDLMNA | |
| SCHEMBL980773 | 0.75 | CFTR (0.64) | CFTRKDM4EALDH1A1HPGDLMNA |
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-2247580-A1 | QUINOXALINONE DERIVATIVES AS INSULIN SECRETION STIMULATORS, METHODS FOR OBTAINING THEM AND USE THEREOF FOR THE TREATMENT OF DIABETES | Merck Patent GmbH (DE) | 2010-11-10 | — | — | EP | disclosed |
| WO-2009109258-A1 | QUINOXALINONE DERIVATIVES AS INSULIN SECRETION STIMULATORS, METHODS FOR OBTAINING THEM AND USE THEREOF FOR THE TREATMENT OF DIABETES | MERCK PATENT GMBH (DE) | 2009-09-11 | — | — | WO | disclosed |