Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | FFAR3 | O14843 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | THRB | P10828 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | ODC1 | P11926 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 2/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL3861265 | 0.82 | ODC1 (0.37) | ALDH1A1ODC1TSHRCYP2D6CYP2C19 | |
| SCHEMBL173322 | 0.82 | FFAR3 (0.41) | ALDH1A1FFAR3MEN1CYP1A2THRB | |
| SCHEMBL27684861 | 0.79 | FFAR3 (0.39) | ALDH1A1FFAR3MEN1CYP1A2THRB | |
| Hydrochloric Acid SCHEMBL8901931 | 0.79 | FFAR3 (0.39) | ALDH1A1FFAR3MEN1CYP1A2THRB | |
| SCHEMBL27899335 | 0.79 | FFAR3 (0.39) | ALDH1A1FFAR3MEN1CYP1A2THRB | |
| Ammonia Solution, Strong SCHEMBL9700926 | 0.79 | FFAR3 (0.39) | ALDH1A1FFAR3MEN1CYP1A2THRB | |
| SCHEMBL28210395 | 0.79 | FFAR3 (0.39) | ALDH1A1FFAR3MEN1CYP1A2THRB | |
| SCHEMBL6818431 | 0.79 | FFAR3 (0.39) | ALDH1A1FFAR3MEN1CYP1A2THRB | |
| SCHEMBL28832878 | 0.78 | ALDH1A1 (0.33) | ALDH1A1FFAR3MEN1CYP1A2THRB | |
| SCHEMBL4618155 | 0.78 | MEN1 (0.38) | ALDH1A1FFAR3MEN1CYP1A2THRB |
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 |
|---|---|---|---|---|---|---|---|
| CN-101296922-A | Kinase inhibitors | LILLY CO ELI (US) | 2008-10-29 | — | — | CN | disclosed |
| CN-101296924-A | Pyrazole-isoquinoline urea derivatives as P38 kinase inhibitors | LILLY CO ELI (US) | 2008-10-29 | — | — | CN | disclosed |