Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 2/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.41 |
| ▸ | KCNN4 | O15554 | 2/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.37 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.37 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.36 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.36 |
| ▸ | KIF11 | P52732 | 3/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | TACR1 | P25103 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 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 | |
|---|---|---|---|---|
| SCHEMBL19954706 | 0.82 | KIF11 (0.40) | CYP2D6CYP1A2TAAR1KCNN4CYP2C19 | |
| SCHEMBL19954740 | 0.77 | CSNK1E (0.38) | KMT2AALDH1A1 | |
| SCHEMBL19954685 | 0.77 | TAAR1 (0.48) | CYP2D6CYP1A2TAAR1KCNN4CYP2C19 | |
| SCHEMBL155932 | 0.77 | TAAR1 (0.52) | CYP2D6CYP1A2TAAR1KCNN4CYP2C19 | |
| SCHEMBL19954719 | 0.75 | TAAR1 (0.46) | CYP2D6CYP1A2TAAR1KCNN4CYP2C19 | |
| Ammonia Solution, Strong SCHEMBL28564622 | 0.74 | TAAR1 (0.50) | CYP2D6CYP1A2TAAR1KCNN4CYP2C19 | |
| Hydrochloric Acid SCHEMBL27971160 | 0.73 | TAAR1 (0.48) | CYP2D6CYP1A2TAAR1KCNN4CYP2C19 | |
| SCHEMBL10325859 | 0.73 | CYP2D6 (0.45) | CYP2D6CYP1A2TAAR1KCNN4CYP2C19 | |
| SCHEMBL608454 | 0.72 | CYP2D6 (0.54) | CYP2D6CYP1A2TAAR1KCNN4CYP2C19 | |
| SCHEMBL1538270 | 0.72 | TAAR1 (0.46) | TAAR1KCNN4CYP2C19HIF1AMAPK1 |
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 |
|---|---|---|---|---|---|---|---|
| US-9917273-B2 | Cross-linking polymer and organic electroluminescent element using same | IDEMITSU KOSAN CO., LTD. (JP) | 2018-03-13 | — | — | US | disclosed |