Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ENPP3 | O14638 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 2/20 | 0.36 |
| ▸ | CA2 | P00918 | 2/20 | 0.36 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.33 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.33 |
| ▸ | XDH | P47989 | 1/20 | 0.33 |
| ▸ | SLC22A12 | Q96S37 | 1/20 | 0.33 |
| ▸ | PTGER4 | P35408 | 1/20 | 0.32 |
| ▸ | ABL1 | P00519 | 2/20 | 0.32 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.31 |
| ▸ | EGFR | P00533 | 1/20 | 0.31 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.30 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.30 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.30 |
| ▸ | TSHR | P16473 | 1/20 | 0.30 |
| ▸ | AR | P10275 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL19563785 | 0.91 | ENPP3 (0.38) | ENPP3CA1CA2CYP11B1CYP11B2 | |
| SCHEMBL21710470 | 0.89 | ENPP3 (0.40) | ENPP3CA1CA2CYP11B1CYP11B2 | |
| SCHEMBL21717870 | 0.83 | ENPP3 (0.39) | ENPP3CA1CA2CYP11B1CYP11B2 | |
| SCHEMBL19563848 | 0.82 | ENPP3 (0.38) | ENPP3CA1CA2CYP11B1CYP11B2 | |
| SCHEMBL21717346 | 0.80 | PTGER4 (0.37) | ENPP3CA1CA2CYP11B1CYP11B2 | |
| SCHEMBL22088254 | 0.79 | PTGER4 (0.34) | ENPP3CYP11B1CYP11B2PTGER4ABL1 | |
| SCHEMBL22088217 | 0.78 | KDM4E (0.35) | CYP11B1CYP11B2PTGER4CHEK1TSHR | |
| SCHEMBL21710482 | 0.77 | PTGER4 (0.38) | ENPP3CA1CA2CYP11B1CYP11B2 | |
| SCHEMBL19563987 | 0.77 | CYP11B1 (0.35) | CYP11B1CYP11B2ABL1CHEK1 | |
| SCHEMBL19563808 | 0.77 | PTGDR2 (0.39) | ENPP3CA1CA2CYP11B2 |
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-3269720-B1 | NOVEL COMPOUND, ORGANIC ELECTROLUMINESCENT ELEMENT, AND ELECTRONIC APPLIANCE | IDEMITSU KOSAN CO (JP) | 2020-06-17 | — | — | EP | disclosed |