Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.52 |
| ▸ | TYR | P14679 | 3/20 | 0.52 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.52 |
| ▸ | LMNA | P02545 | 2/20 | 0.52 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.52 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.52 |
| ▸ | MIF | P14174 | 1/20 | 0.52 |
| ▸ | HTT | P42858 | 1/20 | 0.52 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.52 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.52 |
| ▸ | GABRA1 | P14867 | 4/20 | 0.43 |
| ▸ | GABRB2 | P47870 | 4/20 | 0.43 |
| ▸ | POLB | P06746 | 2/20 | 0.38 |
| ▸ | GAA | P10253 | 4/20 | 0.37 |
| ▸ | ESR1 | P03372 | 2/20 | 0.36 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.36 |
| ▸ | XDH | P47989 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 3/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL122737 | 0.81 | GABRA1 (0.43) | ALDH1A1TYRALOX15LMNANR1I2 | |
| SCHEMBL29418951 | 0.81 | GABRA1 (0.43) | ALDH1A1TYRALOX15LMNANR1I2 | |
| SCHEMBL10586839 | 0.80 | TYR (0.59) | ALDH1A1TYRALOX15LMNANR1I2 | |
| SCHEMBL5385308 | 0.80 | ALDH1A1 (0.59) | ALDH1A1TYRALOX15LMNANR1I2 | |
| SCHEMBL4634692 | 0.79 | TYR (0.57) | ALDH1A1TYRALOX15LMNANR1I2 | |
| SCHEMBL4446113 | 0.78 | GABRA1 (0.50) | ALDH1A1TYRGABRA1GABRB2POLB | |
| SCHEMBL10413004 | 0.78 | GABRA1 (0.43) | CYP2C9GABRA1GABRB2POLBGAA | |
| SCHEMBL11115074 | 0.77 | GABRA1 (0.46) | ALDH1A1TYRGABRA1GABRB2POLB | |
| SCHEMBL11495679 | 0.76 | GABRA1 (0.42) | ALDH1A1CYP2C9GABRA1GABRB2POLB | |
| SCHEMBL69697 | 0.76 | TYR (0.58) | ALDH1A1TYRALOX15HTTGABRA1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2009074664-A1 | LUBRICATING OIL COMPOSITION | SHELL INTERNATIONALE RESEARCH MAATSCHAPPIJ B.V. (NL) | 2009-06-18 | — | — | WO | disclosed |