Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPRT1 | P00492 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.38 |
| ▸ | MITF | O75030 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.37 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.37 |
| ▸ | CASP6 | P55212 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 3/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 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 | |
|---|---|---|---|---|
| SCHEMBL18914940 | 0.87 | HPRT1 (0.43) | HPRT1CYP1A2CYP3A4ALDH1A1TDP1 | |
| SCHEMBL18915041 | 0.86 | NPC1 (0.40) | CYP1A2CYP3A4ALDH1A1TDP1CYP2C9 | |
| SCHEMBL18915032 | 0.84 | MEN1 (0.38) | CYP1A2CYP3A4ALDH1A1TDP1CYP2C9 | |
| SCHEMBL19660346 | 0.76 | HPRT1 (0.61) | HPRT1CYP1A2CYP3A4ALDH1A1TDP1 | |
| SCHEMBL305477 | 0.73 | FGFR1 (0.47) | CYP1A2CYP3A4ALDH1A1TDP1CYP2C9 | |
| SCHEMBL18894333 | 0.72 | PTGS1 (0.40) | CYP1A2CYP3A4ALDH1A1TDP1CYP2C9 | |
| SCHEMBL15797015 | 0.72 | CYP1A2 (0.54) | CYP1A2CYP3A4ALDH1A1TDP1CYP2C9 | |
| SCHEMBL15797007 | 0.69 | NR3C1 (0.52) | CYP1A2CYP3A4ALDH1A1TDP1CYP2C9 | |
| SCHEMBL16415953 | 0.67 | NR3C1 (0.46) | LMNAMAPTNPC1HPGDRAB9A | |
| SCHEMBL15797029 | 0.67 | NR3C1 (0.46) | CYP1A2CYP3A4CYP2C9CYP2C19PTGS1 |
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-2017090901-A1 | ORGANIC LIGHT EMITTING COMPOUND AND ORGANIC ELECTROLUMINESCENT ELEMENT USING SAME | 주식회사 두산 | 2017-06-01 | — | — | WO | disclosed |