Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.36 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | DRD2 | P14416 | 2/20 | 0.34 |
| ▸ | SLC18A3 | Q16572 | 1/20 | 0.33 |
| ▸ | L3MBTL3 | Q96JM7 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL19354324 | 1.00 | CYP1A2 (0.41) | CYP1A2CYP2D6MEN1KMT2ALMNA | |
| SCHEMBL17662672 | 0.90 | — | — | |
| SCHEMBL17662649 | 0.90 | — | — | |
| SCHEMBL14962056 | 0.90 | — | — | |
| SCHEMBL14253891 | 0.85 | CYP2D6 (0.33) | CYP1A2CYP2D6MEN1KMT2ALMNA | |
| SCHEMBL7646035 | 0.84 | SLC18A3 (0.35) | CYP1A2CYP2D6MEN1KMT2ALMNA | |
| SCHEMBL16350305 | 0.84 | CHRM2 (0.37) | DRD2L3MBTL3 | |
| SCHEMBL24914761 | 0.83 | L3MBTL3 (0.46) | CYP1A2OPRM1OPRL1ALDH1A1L3MBTL1 | |
| SCHEMBL11069163 | 0.83 | L3MBTL3 (0.46) | CYP1A2OPRM1OPRL1ALDH1A1L3MBTL1 | |
| SCHEMBL17520885 | 0.83 | L3MBTL3 (0.46) | CYP1A2OPRM1OPRL1ALDH1A1L3MBTL1 |
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-3313397-B1 | PURINE INHIBITORS OF HUMAN PHOSPHATIDYLINOSITOL 3-KINASE DELTA | MERCK SHARP & DOHME (US) | 2020-11-25 | — | — | EP | disclosed |