Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.58 |
| ▸ | RELA | Q04206 | 1/20 | 0.48 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 4/20 | 0.44 |
| ▸ | TP53 | P04637 | 2/20 | 0.44 |
| ▸ | RAB9A | P51151 | 2/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | RECQL | P46063 | 1/20 | 0.43 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.42 |
| ▸ | ACHE | P22303 | 2/20 | 0.42 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.42 |
| ▸ | NFE2L2 | Q16236 | 2/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL679555 | 0.92 | ALDH1A1 (0.69) | ALDH1A1RELACYP2A6TDP1TP53 | |
| SCHEMBL14911 | 0.92 | — | — | |
| Ethylene SCHEMBL10713150 | 0.89 | ALDH1A1 (0.65) | ALDH1A1RELACYP2A6TDP1TP53 | |
| Hydrochloric Acid SCHEMBL9861453 | 0.89 | ALDH1A1 (0.65) | ALDH1A1RELACYP2A6TDP1TP53 | |
| SCHEMBL30733322 | 0.89 | ALDH1A1 (0.65) | ALDH1A1RELACYP2A6TDP1TP53 | |
| Ethane SCHEMBL23051531 | 0.89 | ALDH1A1 (0.65) | ALDH1A1RELACYP2A6TDP1TP53 | |
| Ammonia Solution, Strong SCHEMBL9397572 | 0.89 | ALDH1A1 (0.65) | ALDH1A1RELACYP2A6TDP1TP53 | |
| Hydrochloric Acid SCHEMBL9861440 | 0.89 | ALDH1A1 (0.65) | ALDH1A1RELACYP2A6TDP1TP53 | |
| Charcoal, Activated SCHEMBL9462746 | 0.89 | ALDH1A1 (0.65) | ALDH1A1RELACYP2A6TDP1TP53 | |
| Butadiene SCHEMBL5137794 | 0.86 | ALDH1A1 (0.61) | ALDH1A1RELACYP2A6TDP1TP53 |
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-113717209-A | Synthesis method of alkyl silicon compound | 南通大学 | 2021-11-30 | — | — | CN | disclosed |