Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.50 |
| ▸ | MGLL | Q99685 | 3/20 | 0.50 |
| ▸ | LMNA | P02545 | 3/20 | 0.50 |
| ▸ | HTT | P42858 | 2/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.40 |
| ▸ | HPGD | P15428 | 3/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.40 |
| ▸ | THRB | P10828 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 3/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.35 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.35 |
| ▸ | FAAH | O00519 | 2/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | JAK2 | O60674 | 1/20 | 0.34 |
| ▸ | BBOX1 | O75936 | 1/20 | 0.34 |
| ▸ | TP53 | P04637 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL11306732 | 0.78 | SIGMAR1 (0.49) | ALDH1A1MGLLLMNAHTTCYP1A2 | |
| Methyl Alcohol SCHEMBL27921828 | 0.73 | ALDH1A1 (0.60) | ALDH1A1CYP1A2HPGDHSD17B10THRB | |
| Ethane SCHEMBL27966439 | 0.71 | ALDH1A1 (0.63) | ALDH1A1CYP1A2HPGDHSD17B10THRB | |
| Bis(Dimethylaminethiocarbonyl)Monosulfide SCHEMBL23048 | 0.71 | ALDH1A1 (1.00) | ALDH1A1MGLLLMNAHTTCYP1A2 | |
| SCHEMBL26440 | 0.71 | ALDH1A1 (0.71) | ALDH1A1CYP1A2HPGDHSD17B10THRB | |
| SCHEMBL29906043 | 0.71 | ALDH1A1 (0.71) | ALDH1A1CYP1A2HPGDHSD17B10THRB | |
| SCHEMBL6538859 | 0.71 | ALDH1A1 (0.71) | ALDH1A1CYP1A2HPGDHSD17B10THRB | |
| SCHEMBL634848 | 0.71 | ALDH1A1 (0.71) | ALDH1A1CYP1A2HPGDHSD17B10THRB | |
| SCHEMBL3295423 | 0.69 | ALDH1A1 (0.60) | ALDH1A1CYP1A2HPGDHSD17B10THRB | |
| SCHEMBL21885745 | 0.68 | ALDH1A1 (0.67) | ALDH1A1CYP1A2HPGDHSD17B10THRB |
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-109369981-A | Rubber composition | 戚佳轩 | 2019-02-22 | — | — | CN | disclosed |