Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.33 |
| ▸ | ACSS2 | Q9NR19 | 1/20 | 0.31 |
| ▸ | GUSB | P08236 | 1/20 | 0.31 |
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.31 |
| ▸ | CFTR | P13569 | 1/20 | 0.30 |
| ▸ | GOPC | Q9HD26 | 1/20 | 0.30 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.30 |
| ▸ | CYP3A5 | P20815 | 1/20 | 0.30 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
| ▸ | MAPK1 | P28482 | 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 | |
|---|---|---|---|---|
| SCHEMBL18786338 | 0.83 | CYP1A2 (0.41) | CYP1A2CYP2D6CYP2C9HPGDCYP2C19 | |
| SCHEMBL20127198 | 0.72 | CYP3A4 (0.43) | CYP1A2CYP2D6CYP2C9HPGDCYP2C19 | |
| SCHEMBL16219725 | 0.71 | CYP19A1 (0.39) | CYP1A2CYP2D6CYP2C9HPGDCYP2C19 | |
| SCHEMBL29549155 | 0.71 | MEN1 (0.41) | CYP1A2CYP2D6CYP2C9HPGDCYP2C19 | |
| SCHEMBL24314897 | 0.69 | GPR84 (0.43) | CYP1A2CYP2C9HPGDCYP2C19HIF1A | |
| SCHEMBL10331289 | 0.68 | HSD17B10 (0.46) | CYP1A2CYP2D6CYP2C9HPGDCYP2C19 | |
| SCHEMBL30132955 | 0.68 | CYP2A6 (0.44) | CYP1A2CYP2D6CYP2C9HPGDCYP2C19 | |
| SCHEMBL24743383 | 0.68 | CYP2A6 (0.44) | CYP1A2CYP2D6CYP2C9HPGDCYP2C19 | |
| SCHEMBL18786342 | 0.68 | CYP1A2 (0.41) | CYP1A2CYP2D6CYP2C9HPGDCYP2C19 | |
| SCHEMBL18770229 | 0.68 | TRPM4 (0.37) | HPGDHIF1AHSD17B10GUSBGPR84 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2017069443-A1 | ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENT ELEMENT COMPRISING SAME | 주식회사 두산 | 2017-04-27 | — | — | WO | disclosed |