Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ROCK2 | O75116 | 1/20 | 0.39 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | ACMSD | Q8TDX5 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 2/20 | 0.36 |
| ▸ | MCL1 | Q07820 | 2/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | RECQL | P46063 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 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 | |
|---|---|---|---|---|
| SCHEMBL7659676 | 0.86 | CYP1A2 (0.37) | CYP1A2TDP1KDM4EALOX15TSHR | |
| SCHEMBL7655284 | 0.85 | CYP1A2 (0.39) | CYP1A2TDP1KDM4EALOX15TSHR | |
| SCHEMBL7109867 | 0.84 | PDE10A (0.36) | ROCK2ROCK1LMNANTRK1PDE10A | |
| SCHEMBL7656251 | 0.83 | KDM4E (0.39) | CYP1A2TDP1KDM4EALOX15TSHR | |
| SCHEMBL7106490 | 0.80 | MEN1 (0.36) | ROCK2ROCK1LMNANTRK1MEN1 | |
| SCHEMBL7663915 | 0.78 | CYP1A2 (0.36) | CYP1A2TDP1KDM4EALOX15TSHR | |
| SCHEMBL24342211 | 0.76 | TDP1 (0.39) | ROCK2ROCK1TDP1KDM4ENPC1 | |
| SCHEMBL7658471 | 0.76 | ROCK2 (0.39) | ROCK2ROCK1KDM4EL3MBTL1NTRK1 | |
| SCHEMBL7661222 | 0.75 | TDP1 (0.41) | CYP1A2TDP1KDM4EALOX15TSHR | |
| SCHEMBL25094637 | 0.74 | SMN1; SMN2 (0.34) | ROCK2ROCK1KDM4ENPC1LMNA |
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 |
|---|---|---|---|---|---|---|---|
| US-6399613-B1 | N,N'-BIS(2-HYDROXYETHYL)PYRAZINE-2,5- OR -2,6-DICARBOXAMIDE; DIABETES | AVENTIS PHARMA S.A. (FR) | 2002-06-04 | — | — | US | claimed |
| US-6399613-B1 | N,N'-BIS(2-HYDROXYETHYL)PYRAZINE-2,5- OR -2,6-DICARBOXAMIDE; DIABETES | AVENTIS PHARMA S.A. (FR) | 2002-06-04 | — | — | US | disclosed |