Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MCL1 | Q07820 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 4/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.40 |
| ▸ | CLK4 | Q9HAZ1 | 3/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | PRMT5 | O14744 | 1/20 | 0.40 |
| ▸ | WDR77 | Q9BQA1 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.39 |
| ▸ | ACHE | P22303 | 1/20 | 0.39 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | ALOX5AP | P20292 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL20071974 | 0.87 | CYP1A2 (0.49) | MCL1TSHRCYP1A2CYP3A4CYP2D6 | |
| SCHEMBL20407282 | 0.79 | CA12 (0.46) | MCL1TSHRCYP1A2CYP3A4CYP2D6 | |
| SCHEMBL22978749 | 0.78 | MAOB (0.46) | MCL1TSHRALDH1A1MAPK1LMNA | |
| SCHEMBL17536915 | 0.76 | TNKS2 (0.44) | MCL1CYP1A2CYP3A4CYP2D6CYP2C19 | |
| SCHEMBL17536903 | 0.75 | KDM4E (0.45) | MCL1TSHRCYP1A2CYP3A4CYP2D6 | |
| SCHEMBL17536905 | 0.75 | ENPP3 (0.39) | ALDH1A1ACHEPDK2MAPTKDM4E | |
| Toluene SCHEMBL7271060 | 0.74 | ACHE (0.52) | MCL1TSHRCYP1A2ALDH1A1LMNA | |
| SCHEMBL1047559 | 0.74 | CA12 (0.55) | MCL1TSHRALDH1A1LMNAALOX12 | |
| SCHEMBL17536894 | 0.74 | TNKS2 (0.41) | CYP1A2CYP3A4CYP2D6CYP2C19CYP2C9 | |
| SCHEMBL17536896 | 0.74 | TNKS2 (0.41) | CYP1A2CYP3A4CYP2D6CYP2C19CYP2C9 |
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-3351537-A1 | COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME | LG Chem, Ltd. (KR) | 2018-07-25 | — | — | EP | disclosed |