Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNMA1 | Q12791 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.35 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | NPY1R | P25929 | 1/20 | 0.35 |
| ▸ | NPY2R | P49146 | 1/20 | 0.35 |
| ▸ | ABL1 | P00519 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | USP2 | O75604 | 1/20 | 0.33 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.33 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.33 |
| ▸ | CYP46A1 | Q9Y6A2 | 1/20 | 0.33 |
| ▸ | CNR1 | P21554 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.32 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL4668860 | 0.80 | KCNMA1 (0.38) | KCNMA1ALDH1A1KMT2AMEN1KDM4E | |
| SCHEMBL4667518 | 0.69 | KCNMA1 (0.39) | KCNMA1ALDH1A1KMT2AMEN1KDM4E | |
| SCHEMBL14600645 | 0.67 | ALDH1A1 (0.41) | ALDH1A1KMT2AMEN1KDM4EHPGD | |
| SCHEMBL4666092 | 0.64 | ADORA1 (0.46) | KDM4E | |
| SCHEMBL10174510 | 0.62 | ABL1 (0.57) | ALDH1A1KMT2AMEN1KDM4EHPGD | |
| SCHEMBL31511630 | 0.62 | CYP46A1 (0.58) | KCNMA1ALDH1A1KMT2AMEN1HPGD | |
| SCHEMBL852809 | 0.61 | ABL1 (0.59) | ALDH1A1KMT2AMEN1KDM4EABL1 | |
| SCHEMBL10487662 | 0.60 | ABL1 (0.62) | ALDH1A1KMT2AMEN1KDM4EHPGD | |
| SCHEMBL10598773 | 0.59 | KMT2A (0.45) | ALDH1A1KMT2AMEN1KDM4EHPGD | |
| SCHEMBL4160132 | 0.59 | OPRK1 (0.44) | ALDH1A1KMT2AMEN1KDM4EHPGD |
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-1928455-A1 | ANILINOPYRAZOLE DERIVATIVES USEFUL FOR THE TREATMENT OF DIABETES | Bayer Healthcare, LLC (US) | 2008-06-11 | — | — | EP | disclosed |
| WO-2007027842-A1 | ANILINOPYRAZOLE DERIVATIVES USEFUL FOR THE TREATMENT OF DIABETES | BAYER HEALTHCARE LLC (US) | 2007-03-08 | — | — | WO | disclosed |