Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NQO1 | P15559 | 4/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.35 |
| ▸ | LCK | P06239 | 1/20 | 0.35 |
| ▸ | FYN | P06241 | 1/20 | 0.35 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | ACHE | P22303 | 1/20 | 0.35 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.35 |
| ▸ | AHR | P35869 | 1/20 | 0.35 |
| ▸ | CDK4 | P11802 | 1/20 | 0.34 |
| ▸ | CCND1 | P24385 | 1/20 | 0.34 |
| ▸ | KIF11 | P52732 | 1/20 | 0.34 |
| ▸ | HPRT1 | P00492 | 1/20 | 0.33 |
| ▸ | ANPEP | P15144 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | USP2 | O75604 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL28013632 | 0.85 | NQO1 (0.36) | NQO1ALDH1A1CYP1A2LCKFYN | |
| SCHEMBL28014354 | 0.85 | ANPEP (0.36) | ALDH1A1CYP1A2LCKFYNADORA3 | |
| SCHEMBL28161023 | 0.83 | HRH3 (0.37) | ALDH1A1CYP1A2LCKFYNADORA3 | |
| SCHEMBL28014307 | 0.83 | ADRA2A (0.35) | ALDH1A1CYP1A2HPRT1MEN1USP2 | |
| Propylene Oxide SCHEMBL28239237 | 0.79 | ALDH1A1 (0.41) | NQO1ALDH1A1CYP1A2LCKFYN | |
| Benzoquinone SCHEMBL27308277 | 0.79 | HPRT1 (0.44) | NQO1ALDH1A1CYP1A2LCKFYN | |
| Ethane SCHEMBL27403615 | 0.79 | HPRT1 (0.50) | NQO1ALDH1A1CYP1A2LCKFYN | |
| SCHEMBL30928215 | 0.79 | HPRT1 (0.54) | NQO1ALDH1A1CYP1A2LCKFYN | |
| SCHEMBL21176632 | 0.79 | HPRT1 (0.54) | NQO1ALDH1A1CYP1A2LCKFYN | |
| SCHEMBL2089665 | 0.79 | HPRT1 (0.54) | NQO1ALDH1A1CYP1A2LCKFYN |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-104508001-B | Process for producing polyester and polyurethane | 基因组股份公司 | 2017-07-07 | — | — | CN | claimed |
| CN-107602824-A | The manufacture method of polyester and polyurethanes | 基因组股份公司 | 2018-01-19 | — | — | CN | disclosed |
| CN-104508001-B | Process for producing polyester and polyurethane | 基因组股份公司 | 2017-07-07 | — | — | CN | disclosed |
| CN-104640830-A | Method for producing 1, 4-butanediol | MITSUBISHI CHEM CORP | 2015-05-20 | — | — | CN | disclosed |
| CN-104508001-A | Process for producing polyester and polyurethane | MITSUBISHI CHEM CORP | 2015-04-08 | — | — | CN | disclosed |