Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.49 |
| ▸ | TSHR | P16473 | 2/20 | 0.44 |
| ▸ | LTA4H | P09960 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | GLA | P06280 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | FAAH | O00519 | 1/20 | 0.43 |
| ▸ | TRPM4 | Q8TD43 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.43 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.43 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.43 |
| ▸ | HPRT1 | P00492 | 1/20 | 0.41 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 2/20 | 0.40 |
| ▸ | RCE1 | Q9Y256 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL8127738 | 0.87 | GPR84 (0.55) | GPR84TSHRKMT2AKDM4EMAPT | |
| SCHEMBL441525 | 0.80 | HPRT1 (0.54) | TSHRLTA4HKMT2AKDM4EGLA | |
| SCHEMBL5992232 | 0.79 | NQO2 (0.52) | TSHRLTA4HKMT2AKDM4EGLA | |
| SCHEMBL28130039 | 0.78 | TRPM4 (0.52) | GPR84TSHRKMT2AKDM4EGLA | |
| SCHEMBL28130040 | 0.78 | GPR84 (0.55) | GPR84TSHRKMT2AKDM4EMAPT | |
| SCHEMBL14280977 | 0.78 | LTA4H (0.52) | TSHRLTA4HKMT2AKDM4EGLA | |
| SCHEMBL29986145 | 0.77 | ALDH1A1 (0.57) | TSHRLTA4HKMT2AKDM4EGLA | |
| SCHEMBL536544 | 0.77 | LTA4H (0.58) | TSHRLTA4HKMT2AKDM4EGLA | |
| SCHEMBL9693024 | 0.77 | LTA4H (0.46) | TSHRLTA4HKMT2AKDM4EGLA | |
| SCHEMBL19612255 | 0.76 | NQO1 (0.44) | LTA4HKMT2AKDM4EGLAMAPT |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1201633-B1 | Process for the production of 1,3-propanediol | DU PONT (US) | 2004-06-23 | — | — | EP | disclosed |
| US-6693222-B2 | HYDRATING ACROLEIN USING ACID CATALYST, CATALYTICALLY HYDROGENATING PRODUCT, REFINING MIXTURE CONTAINING WATER, 1,3-PROPANEDIOL AND HIGH BOILING BY-PRODUCTS, TREATING BOILER SUMP IN AQUEOUS SOLUTION WITH ACID CATALYST, NEUTRALIZING | E. I. DU PONT DE NEMOURS AND COMPANY | 2004-02-17 | — | — | US | disclosed |
| US-20030187308-A1 | PROCESS FOR SPLITTING WATER-SOLUBLE ETHERS | E. I. DU PONT DE NEMOURS AND COMPANY | 2003-10-02 | — | — | US | disclosed |
| EP-1201633-A1 | Process for the cleavage of water-soluble ethers | E.I. DUPONT DE NEMOURS AND COMPANY (US) | 2002-05-02 | — | — | EP | disclosed |