Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.57 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.57 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.57 |
| ▸ | HPGD | P15428 | 2/20 | 0.57 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.57 |
| ▸ | LMNA | P02545 | 1/20 | 0.57 |
| ▸ | PDE4A | P27815 | 1/20 | 0.54 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.54 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.54 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.54 |
| ▸ | GALR3 | O60755 | 1/20 | 0.47 |
| ▸ | NR2F2 | P24468 | 1/20 | 0.47 |
| ▸ | RAB9A | P51151 | 1/20 | 0.47 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.46 |
| ▸ | CASP1 | P29466 | 1/20 | 0.45 |
| ▸ | CASP7 | P55210 | 1/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL983167 | 0.99 | MAPK1 (0.59) | ALDH1A1KDM4EMAPK1HPGDHSD17B10 | |
| SCHEMBL979976 | 0.93 | KDM4E (0.66) | ALDH1A1KDM4EMAPK1HPGDHSD17B10 | |
| SCHEMBL985091 | 0.83 | MAPK1 (0.66) | ALDH1A1KDM4EMAPK1HPGDHSD17B10 | |
| SCHEMBL982699 | 0.77 | KDM4E (0.68) | ALDH1A1KDM4EMAPK1HPGDHSD17B10 | |
| SCHEMBL982499 | 0.76 | MAPK1 (0.75) | ALDH1A1KDM4EMAPK1HPGDHSD17B10 | |
| SCHEMBL981898 | 0.74 | KDM4E (1.00) | ALDH1A1KDM4EMAPK1HPGDHSD17B10 | |
| SCHEMBL981117 | 0.73 | ALDH1A1 (0.61) | ALDH1A1KDM4EMAPK1HPGDHSD17B10 | |
| SCHEMBL979635 | 0.73 | CFTR (0.64) | ALDH1A1KDM4EMAPK1HPGDHSD17B10 | |
| SCHEMBL980624 | 0.72 | KDM4E (0.77) | ALDH1A1KDM4EMAPK1HPGDHSD17B10 | |
| SCHEMBL979729 | 0.72 | MAPK1 (0.68) | ALDH1A1KDM4EMAPK1HPGDHSD17B10 |
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 | claimed |
| 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 | claimed |