Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GABRA1 | P14867 | 1/20 | 0.40 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 4/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.38 |
| ▸ | POLB | P06746 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | PKM | P14618 | 1/20 | 0.37 |
| ▸ | RECQL | P46063 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.36 |
| ▸ | ESR1 | P03372 | 5/20 | 0.35 |
| ▸ | ESR2 | Q92731 | 3/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL7524657 | 0.82 | ALDH1A1 (0.47) | GABRA1GABRB2CYP2C19CYP1A2CYP2C9 | |
| SCHEMBL11988588 | 0.80 | GABRA1 (0.43) | GABRA1GABRB2CYP2C19CYP1A2CYP2C9 | |
| SCHEMBL16977972 | 0.77 | ALDH1A1 (0.55) | GABRA1GABRB2CYP2C19CYP1A2CYP2C9 | |
| SCHEMBL201609 | 0.76 | GABRA1 (0.57) | GABRA1GABRB2CYP2C19CYP1A2CYP2C9 | |
| SCHEMBL28119481 | 0.74 | GABRA1 (0.55) | GABRA1GABRB2CYP2C19CYP1A2CYP2C9 | |
| SCHEMBL10887261 | 0.73 | GABRA1 (0.48) | GABRA1GABRB2CYP2C19CYP1A2CYP2C9 | |
| SCHEMBL3826147 | 0.72 | CA2 (0.46) | GABRA1GABRB2CYP2C19CYP1A2CYP2C9 | |
| SCHEMBL14671408 | 0.71 | GABRA1 (0.41) | GABRA1GABRB2CYP2C19CYP1A2CYP2C9 | |
| SCHEMBL19732817 | 0.70 | GABRA1 (0.50) | GABRA1GABRB2CYP2C19CYP1A2CYP2C9 | |
| Dimethylamine SCHEMBL8990212 | 0.70 | GABRA1 (0.50) | GABRA1GABRB2CYP2C19CYP1A2CYP2C9 |
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-20150217602-A1 | CORD RUBBERIZED IN SITU COMPRISING A COMPOSITION CONTAINING AN ORGANIC POLYSULPHIDE | COMPAGNIE GENERALE DES ETABLISSEMENTS MICHELIN (FR) | 2015-08-06 | — | — | US | disclosed |