Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 1/20 | 0.53 |
| ▸ | CA2 | P00918 | 1/20 | 0.53 |
| ▸ | PKM | P14618 | 2/20 | 0.44 |
| ▸ | FBP1 | P09467 | 1/20 | 0.44 |
| ▸ | HTR6 | P50406 | 3/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.40 |
| ▸ | MMP2 | P08253 | 1/20 | 0.40 |
| ▸ | PARL | Q9H300 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL752816 | 0.88 | CA1 (0.65) | CA1CA2PKMFBP1HTR6 | |
| SCHEMBL28910701 | 0.70 | CA1 (0.46) | CA1CA2PKMFBP1ALDH1A1 | |
| SCHEMBL6589513 | 0.70 | PKM (0.53) | CA1CA2PKMHTR6ALDH1A1 | |
| SCHEMBL3018059 | 0.69 | CA2 (0.64) | CA1CA2PKMFBP1KMT2A | |
| SCHEMBL1364805 | 0.69 | CA1 (1.00) | CA1CA2PKMFBP1ALDH1A1 | |
| SCHEMBL16059915 | 0.69 | CA1 (0.59) | CA1CA2PKMFBP1HTR6 | |
| (Phenylsulfonyl)Benzene SCHEMBL9405432 | 0.69 | HTR6 (0.78) | CA1CA2PKMHTR6ALDH1A1 | |
| Imidazole SCHEMBL21065544 | 0.69 | CA1 (0.45) | CA1CA2PKMFBP1HTR6 | |
| SCHEMBL12419386 | 0.69 | CA2 (0.58) | CA1CA2PKMFBP1TSHR | |
| SCHEMBL20741109 | 0.67 | CA1 (0.50) | CA1CA2PKMFBP1HTR6 |
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-105556729-A | Nonaqueous electrolyte composition | DU PONT | 2016-05-04 | — | — | CN | disclosed |