Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 4/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.44 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.44 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | MIF | P14174 | 1/20 | 0.44 |
| ▸ | TYR | P14679 | 1/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | AKR1C3 | P42330 | 10/20 | 0.36 |
| ▸ | AKR1C2 | P52895 | 10/20 | 0.36 |
| ▸ | AKR1C1 | Q04828 | 3/20 | 0.36 |
| ▸ | PTGS1 | P23219 | 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 | |
|---|---|---|---|---|
| SCHEMBL29378822 | 0.82 | CYP2C9 (0.52) | CYP2C9HSD17B10LMNAALOX15NR1I2 | |
| SCHEMBL74988 | 0.82 | CYP2C9 (0.52) | CYP2C9HSD17B10LMNAALOX15NR1I2 | |
| SCHEMBL3460224 | 0.80 | HSD17B10 (0.42) | CYP2C9HSD17B10LMNAALOX15NR1I2 | |
| SCHEMBL28299475 | 0.79 | ALDH1A1 (0.42) | CYP2C9HSD17B10LMNAALDH1A1CYP1A2 | |
| SCHEMBL740967 | 0.79 | CYP2C9 (0.48) | CYP2C9HSD17B10LMNAALOX15NR1I2 | |
| SCHEMBL10413968 | 0.79 | GLRA3 (0.38) | CYP2C9HSD17B10LMNAALOX15NR1I2 | |
| SCHEMBL4374961 | 0.78 | CYP1A2 (0.42) | CYP2C9HSD17B10LMNAALOX15ALDH1A1 | |
| SCHEMBL1815050 | 0.78 | ALDH1A1 (0.47) | CYP2C9HSD17B10LMNAALOX15NR1I2 | |
| SCHEMBL31149008 | 0.78 | HSD17B10 (0.41) | CYP2C9HSD17B10LMNAALOX15ALDH1A1 | |
| SCHEMBL25242321 | 0.75 | AKR1C3 (0.46) | HSD17B10LMNATYRTSHRMEN1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-103717655-A | Thermally hardenable preparations | HENKEL AG & CO KGAA | 2014-04-09 | — | — | CN | disclosed |