Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 4/20 | 0.50 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.50 |
| ▸ | PPARG | P37231 | 1/20 | 0.49 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.45 |
| ▸ | HTR2B | P41595 | 2/20 | 0.45 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.45 |
| ▸ | MAOA | P21397 | 1/20 | 0.45 |
| ▸ | HTR2C | P28335 | 1/20 | 0.45 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.45 |
| ▸ | CNR1 | P21554 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.43 |
| ▸ | MAPT | P10636 | 3/20 | 0.43 |
| ▸ | HPGD | P15428 | 3/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.43 |
| ▸ | NPC1 | O15118 | 3/20 | 0.43 |
| ▸ | RAB9A | P51151 | 3/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | SLC1A3 | P43003 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL15906933 | 0.93 | CYP1A2 (0.55) | CYP1A2HSD17B10CYP3A4SLC6A2HTR2B | |
| SCHEMBL26322229 | 0.91 | HSD17B10 (0.54) | CYP1A2HSD17B10CYP3A4PPARGSLC6A2 | |
| SCHEMBL19243955 | 0.90 | ALDH1A1 (0.44) | CYP1A2HSD17B10CYP3A4PPARGSLC6A2 | |
| SCHEMBL1921940 | 0.90 | CYP1A2 (0.58) | CYP1A2HSD17B10CYP3A4SLC6A2HTR2B | |
| SCHEMBL2522352 | 0.89 | CYP1A2 (0.56) | CYP1A2HSD17B10CYP3A4PPARGSLC6A2 | |
| SCHEMBL23252899 | 0.88 | CYP1A2 (0.47) | CYP1A2HSD17B10CYP3A4SLC6A2HTR2B | |
| SCHEMBL25458414 | 0.87 | CNR1 (0.53) | CYP1A2HSD17B10CYP3A4PPARGSLC6A2 | |
| SCHEMBL2165580 | 0.84 | CYP1A2 (0.60) | CYP1A2HSD17B10CYP3A4SLC6A2HTR2B | |
| SCHEMBL25732937 | 0.84 | CYP1A2 (0.47) | CYP1A2HSD17B10CYP3A4SLC6A2HTR2B | |
| SCHEMBL1921953 | 0.84 | CYP1A2 (0.64) | CYP1A2HSD17B10CYP3A4SLC6A2HTR2B |
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-3006433-B1 | COMPOUND, ORGANIC LIGHT EMITTING ELEMENT COMPRISING SAME, AND DISPLAY DEVICE COMPRISING ORGANIC LIGHT EMITTING ELEMENT | CHEIL IND INC (KR) | 2018-01-31 | — | — | EP | disclosed |