Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PYCR1 | P32322 | 1/20 | 0.41 |
| ▸ | CTSK | P43235 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 3/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.37 |
| ▸ | NPC1 | O15118 | 2/20 | 0.37 |
| ▸ | RAB9A | P51151 | 2/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.36 |
| ▸ | AGER | Q15109 | 1/20 | 0.36 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
| ▸ | IDO1 | P14902 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL2548456 | 0.77 | PYCR1 (0.48) | PYCR1CTSKCYP1A2CYP2D6CYP2C19 | |
| SCHEMBL11693602 | 0.72 | SIGMAR1 (0.46) | PYCR1CTSKCYP1A2CYP2D6CYP2C19 | |
| SCHEMBL7420977 | 0.70 | PYCR1 (0.43) | PYCR1CTSKCYP1A2CYP2D6CYP2C19 | |
| SCHEMBL9288254 | 0.68 | AGER (0.61) | MEN1KMT2ANPC1RAB9AGAA | |
| SCHEMBL17605180 | 0.68 | PYCR1 (0.44) | PYCR1CTSKCYP1A2CYP2D6CYP2C19 | |
| SCHEMBL17605856 | 0.68 | PYCR1 (0.44) | PYCR1CTSKCYP1A2CYP2D6CYP2C19 | |
| SCHEMBL13041050 | 0.68 | SMN1; SMN2 (0.70) | CYP1A2CYP2D6CYP2C19MEN1KMT2A | |
| SCHEMBL3833687 | 0.67 | SIGMAR1 (0.79) | CYP1A2CYP2D6LMNATAAR1SIGMAR1 | |
| SCHEMBL2014415 | 0.66 | FPR2 (0.53) | CTSKGAAMAPTL3MBTL1 | |
| SCHEMBL9087363 | 0.66 | AGER (0.53) | CTSKCYP2D6LMNAAGERSIGMAR1 |
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-2418033-B1 | METAL COMPLEX AND COMPOSITION CONTAINING SAME | SUMITOMO CHEMICAL CO (JP) | 2020-05-06 | — | — | EP | disclosed |