Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | S1PR5 | Q9H228 | 7/20 | 0.43 |
| ▸ | S1PR4 | O95977 | 1/20 | 0.43 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.43 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.38 |
| ▸ | BCHE | P06276 | 1/20 | 0.37 |
| ▸ | PKM | P14618 | 1/20 | 0.37 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 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 | |
|---|---|---|---|---|
| SCHEMBL24131518 | 1.00 | MEN1 (0.44) | MEN1KMT2AS1PR5S1PR4S1PR1 | |
| SCHEMBL7517115 | 0.83 | S1PR5 (0.41) | S1PR5S1PR4S1PR1S1PR3SMN1; SMN2 | |
| SCHEMBL7398354 | 0.82 | S1PR5 (0.44) | MEN1KMT2AS1PR5S1PR4S1PR1 | |
| SCHEMBL19617145 | 0.81 | MEN1 (0.47) | MEN1KMT2AALDH1A1SMN1; SMN2MAPT | |
| SCHEMBL1007316 | 0.78 | SMN1; SMN2 (0.44) | S1PR5S1PR4S1PR1S1PR3ALDH1A1 | |
| SCHEMBL8290943 | 0.78 | MEN1 (0.49) | MEN1KMT2AALDH1A1SIGMAR1 | |
| SCHEMBL7459216 | 0.78 | SMN1; SMN2 (0.44) | S1PR5S1PR4S1PR1S1PR3ALDH1A1 | |
| SCHEMBL1008401 | 0.78 | SMN1; SMN2 (0.44) | S1PR5S1PR4S1PR1S1PR3ALDH1A1 | |
| SCHEMBL7402269 | 0.78 | SIGMAR1 (0.54) | MEN1KMT2AS1PR5S1PR4S1PR1 | |
| SCHEMBL13739335 | 0.77 | SMN1; SMN2 (0.57) | S1PR5S1PR4S1PR1S1PR3ALDH1A1 |
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-2021254254-A1 | ORGANIC ARSENIC-BASED TYPE II PYRUVATE KINASE INHIBITOR AS WELL AS PREPARATION METHOD THEREFOR AND USE THEREOF | 中国科学院上海有机化学研究所 | 2021-12-23 | — | — | WO | disclosed |
| EP-3710439-A1 | KRAS G12C INHIBITORS | Mirati Therapeutics, Inc. (US) | 2020-09-23 | — | — | EP | disclosed |