Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIM1 | P11309 | 4/20 | 0.39 |
| ▸ | IDH1 | O75874 | 1/20 | 0.39 |
| ▸ | IDH2 | P48735 | 1/20 | 0.39 |
| ▸ | ABHD6 | Q9BV23 | 2/20 | 0.38 |
| ▸ | DAGLA | Q9Y4D2 | 1/20 | 0.38 |
| ▸ | THRB | P10828 | 2/20 | 0.37 |
| ▸ | PIM3 | Q86V86 | 1/20 | 0.37 |
| ▸ | F2RL3 | Q96RI0 | 2/20 | 0.37 |
| ▸ | IRAK4 | Q9NWZ3 | 1/20 | 0.37 |
| ▸ | TYRO3 | Q06418 | 2/20 | 0.37 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | CDK9 | P50750 | 1/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.36 |
| ▸ | SCD5 | Q86SK9 | 1/20 | 0.36 |
| ▸ | CSNK1D | P48730 | 1/20 | 0.36 |
| ▸ | CSNK1E | P49674 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL623873 | 0.90 | IDH1 (0.44) | PIM1IDH1IDH2ABHD6DAGLA | |
| SCHEMBL623829 | 0.90 | F2RL3 (0.48) | IDH1IDH2F2RL3MAPTCDK9 | |
| SCHEMBL624454 | 0.89 | PIM1 (0.45) | PIM1ABHD6DAGLAPIM3F2RL3 | |
| SCHEMBL624037 | 0.86 | CYP2D6 (0.39) | IRAK4SCD5HSD17B10 | |
| SCHEMBL625296 | 0.86 | F2RL3 (0.38) | PIM1THRBPIM3F2RL3IRAK4 | |
| SCHEMBL625512 | 0.86 | THRB (0.44) | PIM1THRBF2RL3MAPTSCD5 | |
| SCHEMBL623722 | 0.85 | PIM1 (0.43) | PIM1THRBPIM3F2RL3IRAK4 | |
| SCHEMBL625495 | 0.84 | PIM1 (0.46) | PIM1PIM3KCNH2 | |
| SCHEMBL623996 | 0.84 | THRB (0.42) | PIM1THRBF2RL3IRAK4MAPT | |
| SCHEMBL625561 | 0.84 | PIM1 (0.49) | PIM1PIM3F2RL3TYRO3KCNH2 |
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 |