Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S1PR2 | O95136 | 9/20 | 0.50 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.45 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.45 |
| ▸ | OTUD7B | Q6GQQ9 | 1/20 | 0.44 |
| ▸ | USP2 | O75604 | 2/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.42 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | MET | P08581 | 1/20 | 0.41 |
| ▸ | AXL | P30530 | 1/20 | 0.41 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL4290419 | 0.97 | S1PR2 (0.52) | S1PR2HDAC2HDAC1OTUD7BUSP2 | |
| SCHEMBL1446881 | 0.86 | S1PR2 (0.56) | S1PR2OTUD7BUSP2CYP3A4ALDH1A1 | |
| SCHEMBL20137661 | 0.81 | TSHR (0.52) | CYP3A4ALDH1A1CYP1A2CYP2C19 | |
| SCHEMBL1447574 | 0.80 | LIMK2 (0.55) | EPHX2 | |
| SCHEMBL4866877 | 0.80 | PTPN2 (0.59) | S1PR2ALDH1A1 | |
| SCHEMBL1446944 | 0.77 | S1PR2 (0.48) | S1PR2OTUD7BUSP2ALDH1A1SMN1; SMN2 | |
| SCHEMBL1446961 | 0.77 | CA1 (0.50) | ALDH1A1 | |
| SCHEMBL31058161 | 0.77 | ANO1 (0.53) | S1PR2EPHX2 | |
| SCHEMBL31058254 | 0.76 | PARP14 (0.49) | EPHX2 | |
| SCHEMBL20137885 | 0.76 | TSHR (0.44) | HDAC2HDAC1NTRK1 |
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 |
|---|---|---|---|---|---|---|---|
| US-8450332-B2 | LIMK2 inhibitors, compositions comprising them, and methods of their use | LEXICON PHARMACEUTICALS, INC. (US) | 2013-05-28 | — | — | US | disclosed |