Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.42 |
| ▸ | ATM | Q13315 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 5/20 | 0.40 |
| ▸ | TP53 | P04637 | 5/20 | 0.40 |
| ▸ | RXFP1 | Q9HBX9 | 3/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | BRD4 | O60885 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | CASP1 | P29466 | 1/20 | 0.38 |
| ▸ | CASP7 | P55210 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL18691762 | 0.88 | ATM (0.54) | HDAC6ATMMAPTTP53RXFP1 | |
| SCHEMBL18691789 | 0.87 | TP53 (0.39) | HDAC6ATMMAPTTP53RXFP1 | |
| SCHEMBL18691775 | 0.81 | ELANE (0.45) | RXFP1ALDH1A1KDM4ENPSR1OGFRL1 | |
| SCHEMBL29724622 | 0.80 | ALDH1A1 (0.59) | HDAC6MAPTTP53RXFP1ALDH1A1 | |
| SCHEMBL2783065 | 0.80 | ALDH1A1 (0.59) | HDAC6MAPTTP53RXFP1ALDH1A1 | |
| SCHEMBL18691767 | 0.78 | ALDH1A1 (0.53) | ATMALDH1A1CYP2C9CYP2C19MEN1 | |
| SCHEMBL18691790 | 0.75 | ATM (0.49) | HDAC6ATMMAPTTP53RXFP1 | |
| SCHEMBL15147600 | 0.74 | MEN1 (0.45) | HDAC6MAPTTP53RXFP1ALDH1A1 | |
| SCHEMBL9611670 | 0.70 | ATM (0.77) | ATMMAPTTP53RXFP1ALDH1A1 | |
| SCHEMBL18691781 | 0.70 | ALDH1A1 (0.52) | MAPTALDH1A1CYP2C19MEN1HTT |
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-2247292-B1 | PYRIDOPYRAZINONES DERIVATIVES INSULIN SECRETION STIMULATORS, METHODS FOR OBTAINING THEM AND USE THEREOF FOR THE TREATMENT OF DIABETES | MERCK PATENT GMBH (DE) | 2017-04-12 | — | — | EP | disclosed |