Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 5/20 | 0.53 |
| ▸ | THRB | P10828 | 1/20 | 0.50 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.38 |
| ▸ | ATM | Q13315 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.36 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | APEX1 | P27695 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | RECQL | P46063 | 1/20 | 0.32 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.32 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.32 |
| ▸ | PRSS3 | P35030 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL75001 | 0.91 | TSHR (0.63) | TSHRTHRBTDP1CYP3A4ATM | |
| SCHEMBL15347798 | 0.89 | TSHR (0.55) | TSHRTHRBTDP1CYP3A4ATM | |
| SCHEMBL3974700 | 0.87 | TSHR (0.63) | TSHRTHRBTDP1CYP3A4ATM | |
| Methacrylic Acid SCHEMBL20574597 | 0.85 | TSHR (0.57) | TSHRTHRBTDP1CYP3A4ATM | |
| SCHEMBL21772349 | 0.84 | TSHR (0.69) | TSHRTHRBTDP1ALDH1A1HCAR2 | |
| SCHEMBL16573 | 0.84 | — | — | |
| SCHEMBL9502238 | 0.84 | TSHR (0.78) | TSHRTHRBTDP1ALDH1A1HCAR2 | |
| SCHEMBL31065018 | 0.84 | TSHR (0.78) | TSHRTHRBTDP1ALDH1A1HCAR2 | |
| SCHEMBL6558434 | 0.84 | TSHR (0.55) | TSHRTHRBTDP1CYP3A4ATM | |
| SCHEMBL497290 | 0.83 | TSHR (0.59) | TSHRTHRBTDP1CYP3A4ATM |
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 |
|---|---|---|---|---|---|---|---|
| EP-1928979-A1 | FUNCTIONALIZED PHOTOREACTIVE COMPOUNDS | Rolic AG (CH) | 2008-06-11 | — | — | EP | disclosed |
| WO-2007033506-A1 | FUNCTIONALIZED PHOTOREACTIVE COMPOUNDS | ROLIC AG (CH) | 2007-03-29 | — | — | WO | disclosed |