Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.48 |
| ▸ | S1PR2 | O95136 | 5/20 | 0.37 |
| ▸ | S1PR4 | O95977 | 5/20 | 0.37 |
| ▸ | S1PR1 | P21453 | 5/20 | 0.37 |
| ▸ | S1PR3 | Q99500 | 5/20 | 0.37 |
| ▸ | S1PR5 | Q9H228 | 1/20 | 0.37 |
| ▸ | ADH1B | P00325 | 2/20 | 0.37 |
| ▸ | ADH1C | P00326 | 2/20 | 0.37 |
| ▸ | ADH1A | P07327 | 2/20 | 0.37 |
| ▸ | ADH7 | P40394 | 2/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | EPHX1 | P07099 | 3/20 | 0.35 |
| ▸ | ADH4 | P08319 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL5244237 | 0.96 | TSHR (0.46) | TSHRALDH1A1S1PR2S1PR4S1PR1 | |
| SCHEMBL5245330 | 0.92 | TSHR (0.50) | TSHRALDH1A1ADH1BADH1CADH1A | |
| Dipentylamine SCHEMBL28302348 | 0.85 | TSHR (0.56) | TSHRALDH1A1S1PR2S1PR4S1PR1 | |
| SCHEMBL28435606 | 0.82 | TSHR (0.65) | TSHRALDH1A1S1PR2S1PR4S1PR1 | |
| SCHEMBL7323506 | 0.81 | TSHR (0.47) | TSHRALDH1A1S1PR2S1PR4S1PR1 | |
| SCHEMBL25307948 | 0.79 | TSHR (0.48) | TSHRALDH1A1S1PR2S1PR4S1PR1 | |
| SCHEMBL12321612 | 0.78 | TSHR (0.59) | TSHRALDH1A1S1PR2S1PR4S1PR1 | |
| SCHEMBL22288099 | 0.78 | TSHR (0.59) | TSHRALDH1A1S1PR2S1PR4S1PR1 | |
| SCHEMBL23221900 | 0.78 | ALDH1A1 (0.50) | TSHRALDH1A1ADH1BADH1CADH1A | |
| SCHEMBL15782518 | 0.78 | TSHR (0.51) | TSHRALDH1A1S1PR2S1PR4S1PR1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3731869-A1 | IRAK DEGRADERS AND USES THEREOF | Kymera Therapeutics, Inc. (US) | 2020-11-04 | — | — | EP | disclosed |