Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDH1 | O75874 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | PIK3CD | O00329 | 6/20 | 0.34 |
| ▸ | BRD4 | O60885 | 5/20 | 0.33 |
| ▸ | BRD2 | P25440 | 2/20 | 0.33 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.33 |
| ▸ | CTSA | P10619 | 2/20 | 0.32 |
| ▸ | PFKFB3 | Q16875 | 1/20 | 0.32 |
| ▸ | ATM | Q13315 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 2/20 | 0.30 |
| ▸ | RAB9A | P51151 | 2/20 | 0.30 |
| ▸ | BRD3 | Q15059 | 1/20 | 0.30 |
| ▸ | POLB | P06746 | 1/20 | 0.30 |
| ▸ | CASP3 | P42574 | 1/20 | 0.30 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL1883829 | 1.00 | IDH1 (0.35) | IDH1ALDH1A1SMN1; SMN2PIK3CDBRD4 | |
| SCHEMBL14768026 | 0.88 | HTT (0.38) | IDH1ALDH1A1SMN1; SMN2PIK3CDBRD4 | |
| SCHEMBL14768347 | 0.82 | PIK3CD (0.39) | PIK3CDATM | |
| SCHEMBL1882135 | 0.81 | PIK3CD (0.40) | PIK3CDBRD4BRD2CREBBPCTSA | |
| SCHEMBL1882140 | 0.81 | PIK3CD (0.40) | PIK3CDBRD4BRD2CREBBPCTSA | |
| SCHEMBL1884684 | 0.80 | BRD4 (0.36) | PIK3CDBRD4BRD2CREBBPCTSA | |
| SCHEMBL14768337 | 0.78 | GAA (0.38) | SMN1; SMN2PIK3CDATM | |
| SCHEMBL14768204 | 0.76 | PFKFB3 (0.39) | IDH1PIK3CDPFKFB3 | |
| SCHEMBL14768085 | 0.75 | LMNA (0.42) | ALDH1A1PIK3CDBRD4 | |
| SCHEMBL716189 | 0.74 | TSHR (0.47) | ALDH1A1SMN1; SMN2PIK3CD |
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 |
|---|---|---|---|---|---|---|---|
| US-8399483-B2 | Quinoxaline and quinoline derivatives as kinase inhibitors | UCB PHARMA S.A. (BE) | 2013-03-19 | — | — | US | disclosed |