Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.54 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.54 |
| ▸ | HTR3B | O95264 | 1/20 | 0.54 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.54 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.54 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.54 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.54 |
| ▸ | THPO | P40225 | 1/20 | 0.54 |
| ▸ | HTR3A | P46098 | 1/20 | 0.54 |
| ▸ | HTR3D | Q70Z44 | 1/20 | 0.54 |
| ▸ | HTR3C | Q8WXA8 | 1/20 | 0.54 |
| ▸ | HTR1D | P28221 | 1/20 | 0.51 |
| ▸ | HTR2C | P28335 | 1/20 | 0.51 |
| ▸ | HTR6 | P50406 | 1/20 | 0.51 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.49 |
| ▸ | SIRT6 | Q8N6T7 | 1/20 | 0.49 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.46 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.46 |
| ▸ | CASP1 | P29466 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| Tert-Butyl Formate SCHEMBL27835007 | 0.86 | ALDH1A1 (0.46) | ALDH1A1HTR3EHTR3BCYP1A2CYP3A4 | |
| SCHEMBL31401096 | 0.82 | ALDH1A1 (0.54) | ALDH1A1CYP1A2CYP2C19LMNA | |
| SCHEMBL9318302 | 0.76 | ALDH1A1 (0.64) | ALDH1A1HTR3EHTR3BCYP1A2CYP3A4 | |
| SCHEMBL6364738 | 0.75 | ALDH1A1 (0.66) | ALDH1A1HTR3EHTR3BCYP1A2CYP3A4 | |
| SCHEMBL9069868 | 0.75 | ALDH1A1 (0.59) | ALDH1A1HTR3EHTR3BCYP1A2CYP3A4 | |
| SCHEMBL31401459 | 0.74 | KMT2A (0.35) | ALDH1A1HTR3EHTR3BCYP1A2CYP3A4 | |
| Hydrochloric Acid SCHEMBL31061212 | 0.73 | ALDH1A1 (0.58) | ALDH1A1HTR3EHTR3BCYP1A2CYP3A4 | |
| SCHEMBL31263688 | 0.73 | ALDH1A1 (0.48) | ALDH1A1CYP1A2CYP2C19LMNANPSR1 | |
| SCHEMBL21635259 | 0.73 | GRIN2D (0.58) | — | |
| SCHEMBL220662 | 0.73 | CYP19A1 (0.50) | ALDH1A1CYP1A2CYP3A4LMNAPMP22 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2009150230-A1 | 2,4'-BIPYRIDINYL COMPOUNDS AS PROTEIN KINASE D INHIBITORS USEFUL FOR THE TREATMENT OF IA HEART FAILURE AND CANCER | NOVARTIS AG (CH) | 2009-12-17 | — | — | WO | disclosed |