Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.57 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.52 |
| ▸ | CA1 | P00915 | 1/20 | 0.47 |
| ▸ | CA2 | P00918 | 1/20 | 0.47 |
| ▸ | STK17B | O94768 | 1/20 | 0.46 |
| ▸ | STK17A | Q9UEE5 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 2/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | DRD2 | P14416 | 2/20 | 0.43 |
| ▸ | IDO1 | P14902 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | PYGL | P06737 | 1/20 | 0.43 |
| ▸ | CCNC | P24863 | 1/20 | 0.43 |
| ▸ | CDK8 | P49336 | 1/20 | 0.43 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL1824975 | 0.86 | TSHR (0.47) | TSHRSMN1; SMN2CA1CA2STK17B | |
| SCHEMBL14830020 | 0.85 | PYGL (0.53) | TSHRSMN1; SMN2CA1CA2STK17B | |
| SCHEMBL14129641 | 0.84 | TSHR (0.57) | TSHRSMN1; SMN2CA1CA2STK17B | |
| SCHEMBL24011136 | 0.82 | GAA (0.58) | SMN1; SMN2CA1CA2GAAMEN1 | |
| SCHEMBL12655254 | 0.82 | TSHR (0.57) | TSHRSMN1; SMN2STK17AHPGDMEN1 | |
| SCHEMBL25834169 | 0.82 | TSHR (0.54) | TSHRSMN1; SMN2CA1CA2GAA | |
| SCHEMBL18130689 | 0.81 | TSHR (0.61) | TSHRSMN1; SMN2CA1CA2GAA | |
| SCHEMBL13664868 | 0.79 | STK17B (0.55) | CA1CA2STK17BSTK17AGAA | |
| SCHEMBL24575982 | 0.78 | TSHR (0.71) | TSHRSMN1; SMN2STK17AHPGDMEN1 | |
| SCHEMBL1829911 | 0.78 | TSHR (0.59) | TSHRSMN1; SMN2GAAHPGD |
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 |
|---|---|---|---|---|---|---|---|
| WO-2011060394-A1 | COMPOUNDS USEFUL AS CHEMOKINE RECEPTOR ANTAGONISTS | SCHERING CORPORATION (US) | 2011-05-19 | — | — | WO | disclosed |
| WO-2011060395-A1 | CYCLIC UREAS USEFUL AS HIV INHIBITORS | SCHERING CORPORATION (US) | 2011-05-19 | — | — | WO | disclosed |