Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FABP4 | P15090 | 1/20 | 0.36 |
| ▸ | RET | P07949 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.35 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | BRD4 | O60885 | 2/20 | 0.34 |
| ▸ | BRD2 | P25440 | 1/20 | 0.34 |
| ▸ | TYMS | P04818 | 1/20 | 0.34 |
| ▸ | RPA1 | P27694 | 1/20 | 0.33 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.33 |
| ▸ | PPARG | P37231 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL19598926 | 0.87 | CYP3A4 (0.43) | FABP4RETCYP3A4TDP1TAAR1 | |
| SCHEMBL15306327 | 0.85 | ALDH1A1 (0.38) | CYP3A4TDP1TAAR1KDM4EALDH1A1 | |
| SCHEMBL19393440 | 0.81 | ALDH1A1 (0.38) | CYP3A4TDP1TAAR1KDM4EALDH1A1 | |
| SCHEMBL17368989 | 0.81 | ALDH1A1 (0.38) | CYP3A4TDP1TAAR1KDM4EALDH1A1 | |
| SCHEMBL7154196 | 0.81 | ACHE (0.39) | CYP3A4TDP1KDM4EALDH1A1CYP1A2 | |
| SCHEMBL13929896 | 0.81 | ACHE (0.39) | CYP3A4TDP1KDM4EALDH1A1CYP1A2 | |
| SCHEMBL1153906 | 0.79 | CYP3A4 (0.43) | CYP3A4TDP1TAAR1KDM4EALDH1A1 | |
| SCHEMBL185396 | 0.79 | CYP3A4 (0.43) | CYP3A4TDP1TAAR1KDM4EALDH1A1 | |
| SCHEMBL2887338 | 0.79 | ALDH1A1 (0.39) | CYP3A4TDP1TAAR1KDM4EALDH1A1 | |
| SCHEMBL17734525 | 0.78 | HSD17B1 (0.37) | ALDH1A1MAPTBRD4TYMS |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6861163-B2 | Aromatic compounds and organic light emitting diodes | NATIONAL TSING HUA UNIVERSITY (TW) | 2005-03-01 | — | — | US | disclosed |
| US-20040076852-A1 | Aromatic compounds and organic light emitting diodes | NATIONAL TSING HUA UNIVERSITY (TW) | 2004-04-22 | — | — | US | disclosed |