Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NISCH | Q9Y2I1 | 1/20 | 0.56 |
| ▸ | RAB9A | P51151 | 2/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.45 |
| ▸ | NPC1 | O15118 | 1/20 | 0.45 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.43 |
| ▸ | TNKS | O95271 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.38 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.38 |
| ▸ | BRD4 | O60885 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 3/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.37 |
| ▸ | LMNA | P02545 | 2/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL5065601 | 0.81 | PDE3B (0.47) | NISCHRAB9AKDM4ENPC1TNKS | |
| SCHEMBL29948010 | 0.81 | PDE3B (0.47) | NISCHKDM4EALDH1A1MEN1KMT2A | |
| SCHEMBL13619043 | 0.81 | PDE3B (0.47) | RAB9AKDM4ENPC1ALDH1A1SMN1; SMN2 | |
| SCHEMBL17151506 | 0.81 | PDE3B (0.47) | RAB9ABRD4 | |
| SCHEMBL5065569 | 0.81 | MTOR (0.53) | NISCHRAB9AKDM4ENPC1ALDH1A1 | |
| SCHEMBL15144399 | 0.81 | PDE3B (0.51) | RAB9AKDM4ENPC1ALDH1A1SMN1; SMN2 | |
| SCHEMBL6619540 | 0.73 | DAO (0.42) | NISCHRAB9AKDM4ENPC1ALDH1A1 | |
| SCHEMBL2904930 | 0.73 | TDP1 (0.46) | NISCHRAB9AKDM4ENPC1ALDH1A1 | |
| SCHEMBL674010 | 0.72 | NISCH (1.00) | NISCHRAB9AKDM4ENPC1ALOX5 | |
| SCHEMBL30719409 | 0.72 | AURKA (0.40) | NISCHALDH1A1SMN1; SMN2MAPTAURKB |
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-2268624-B1 | ARYLPYRAZINONE DERIVATIVES INSULIN SECRETION STIMULATORS, METHODS FOR OBTAINING THEM AND USE THEREOF FOR THE TREATMENT OF DIABETES | MERCK PATENT GMBH (DE) | 2013-07-31 | — | — | EP | disclosed |
| WO-2009132739-A1 | ARYLPYRAZINONE DERIVATIVES INSULIN SECRETION STIMULATORS, METHODS FOR OBTAINING THEM AND USE THEREOF FOR THE TREATMENT OF DIABETES | MERCK PATENT GMBH (DE) | 2009-11-05 | — | — | WO | disclosed |