Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.52 |
| ▸ | MEN1 | O00255 | 5/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.52 |
| ▸ | NPC1 | O15118 | 2/20 | 0.52 |
| ▸ | NOS3 | P29474 | 1/20 | 0.48 |
| ▸ | NOS1 | P29475 | 1/20 | 0.48 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.47 |
| ▸ | LTA4H | P09960 | 1/20 | 0.47 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 6/20 | 0.46 |
| ▸ | RAB9A | P51151 | 3/20 | 0.46 |
| ▸ | HTT | P42858 | 2/20 | 0.46 |
| ▸ | PKM | P14618 | 1/20 | 0.46 |
| ▸ | CASP3 | P42574 | 2/20 | 0.44 |
| ▸ | SENP8 | Q96LD8 | 2/20 | 0.44 |
| ▸ | SENP7 | Q9BQF6 | 2/20 | 0.44 |
| ▸ | SENP6 | Q9GZR1 | 2/20 | 0.44 |
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 | |
|---|---|---|---|---|
| Ethane SCHEMBL28295224 | 1.00 | TSHR (0.54) | TSHRALDH1A1MEN1KMT2ANPC1 | |
| SCHEMBL14690485 | 0.96 | TSHR (0.59) | TSHRALDH1A1MEN1KMT2ANPC1 | |
| SCHEMBL14690487 | 0.96 | TSHR (0.59) | TSHRALDH1A1MEN1KMT2ANPC1 | |
| Azobenzene SCHEMBL29078118 | 0.89 | TSHR (0.70) | TSHRALDH1A1MEN1KMT2ANPC1 | |
| SCHEMBL14690091 | 0.86 | NOS3 (0.54) | TSHRALDH1A1MEN1KMT2ANPC1 | |
| SCHEMBL14690090 | 0.86 | NOS3 (0.54) | TSHRALDH1A1MEN1KMT2ANPC1 | |
| Azobenzene SCHEMBL27839005 | 0.79 | ALDH1A1 (0.67) | TSHRALDH1A1MEN1KMT2ANPC1 | |
| SCHEMBL3870420 | 0.78 | TDP1 (0.62) | TSHRALDH1A1MEN1KMT2ANPC1 | |
| Benzyl Alcohol SCHEMBL20598471 | 0.78 | TSHR (0.88) | TSHRALDH1A1TDP1LTA4HTRPA1 | |
| Azobenzene SCHEMBL11328908 | 0.78 | ALDH1A1 (0.86) | TSHRALDH1A1MEN1KMT2ANPC1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-109694472-B | Functional polyether initiator, synthesis thereof and application thereof in polyether synthesis | 万华化学集团股份有限公司 | 2021-06-29 | — | — | CN | disclosed |
| CN-109694472-A | Functionalised polyethers initiator and its synthesis and the application in polyethers synthesis | 万华化学集团股份有限公司 | 2019-04-30 | — | — | CN | disclosed |