Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | THRB | P10828 | 3/20 | 0.42 |
| ▸ | MAPT | P10636 | 10/20 | 0.41 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.40 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.40 |
| ▸ | SCD5 | Q86SK9 | 1/20 | 0.39 |
| ▸ | F2RL3 | Q96RI0 | 2/20 | 0.38 |
| ▸ | RET | P07949 | 1/20 | 0.38 |
| ▸ | PIM1 | P11309 | 1/20 | 0.37 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.37 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.37 |
| ▸ | MGLL | Q99685 | 1/20 | 0.37 |
| ▸ | IRAK4 | Q9NWZ3 | 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 | |
|---|---|---|---|---|
| SCHEMBL624528 | 0.96 | CYP3A4 (0.41) | THRBMAPTCYP11B2RXFP1SCD5 | |
| SCHEMBL625512 | 0.95 | THRB (0.44) | THRBMAPTCYP11B2RXFP1SCD5 | |
| SCHEMBL623995 | 0.85 | PIM1 (0.44) | CYP11B2RETPIM1 | |
| SCHEMBL623207 | 0.85 | PIM1 (0.48) | THRBMAPTRXFP1F2RL3PIM1 | |
| SCHEMBL625496 | 0.84 | PIM1 (0.39) | THRBMAPTSCD5F2RL3PIM1 | |
| SCHEMBL625742 | 0.84 | THRB (0.43) | THRBMAPTRXFP1F2RL3PIM1 | |
| SCHEMBL624527 | 0.82 | PIM1 (0.43) | RETPIM1 | |
| SCHEMBL624454 | 0.81 | PIM1 (0.45) | F2RL3RETPIM1 | |
| SCHEMBL625511 | 0.80 | PIM1 (0.45) | PIM1 | |
| SCHEMBL623949 | 0.80 | PIM1 (0.47) | THRBMAPTRXFP1F2RL3PIM1 |
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 |