Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIM1 | P11309 | 6/20 | 0.47 |
| ▸ | F2RL3 | Q96RI0 | 3/20 | 0.41 |
| ▸ | SCN9A | Q15858 | 2/20 | 0.41 |
| ▸ | SCN4A | P35499 | 1/20 | 0.41 |
| ▸ | THRB | P10828 | 2/20 | 0.41 |
| ▸ | PIM3 | Q86V86 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 3/20 | 0.40 |
| ▸ | TYRO3 | Q06418 | 1/20 | 0.39 |
| ▸ | XDH | P47989 | 1/20 | 0.38 |
| ▸ | FLT3 | P36888 | 1/20 | 0.38 |
| ▸ | PIM2 | Q9P1W9 | 1/20 | 0.38 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.37 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.37 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.37 |
| ▸ | USP2 | O75604 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL624740 | 0.95 | PIM1 (0.48) | PIM1F2RL3SCN9ASCN4ATHRB | |
| SCHEMBL623207 | 0.95 | PIM1 (0.48) | PIM1F2RL3SCN9ASCN4ATHRB | |
| SCHEMBL625255 | 0.87 | PIM3 (0.48) | PIM1F2RL3THRBPIM3MAPT | |
| SCHEMBL625249 | 0.84 | PIM2 (0.48) | PIM1F2RL3SCN9ASCN4ATHRB | |
| SCHEMBL625512 | 0.84 | THRB (0.44) | PIM1F2RL3THRBMAPTRXFP1 | |
| SCHEMBL623948 | 0.84 | DYRK1A (0.47) | PIM1PIM3 | |
| SCHEMBL625561 | 0.82 | PIM1 (0.49) | PIM1F2RL3PIM3TYRO3XDH | |
| SCHEMBL623867 | 0.81 | PIM1 (0.44) | PIM1F2RL3THRBMAPTXDH | |
| SCHEMBL623996 | 0.80 | THRB (0.42) | PIM1F2RL3THRBMAPTHCRTR1 | |
| SCHEMBL623206 | 0.79 | PIM1 (0.47) | PIM1 |
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-2012020217-A1 | AMINO- IMIDAZOLOTHIADIAZOLES FOR USE AS PROTEIN OR LIPID KINASE INHIBITORS | CENTRO NACIONAL DE INVESTIGACIONES ONCOLÓGICAS (CNIO) (ES) | 2012-02-16 | — | — | WO | disclosed |