Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.44 |
| ▸ | GPR35 | Q9HC97 | 2/20 | 0.41 |
| ▸ | HPGD | P15428 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | THRB | P10828 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 2/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | NLRP3 | Q96P20 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | USP2 | O75604 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL1491944 | 0.81 | ALDH1A1 (0.54) | ALDH1A1HPGDLMNAMAPTTSHR | |
| SCHEMBL18007579 | 0.79 | HPGD (0.41) | ALDH1A1HPGDLMNAMAPTTSHR | |
| SCHEMBL30487417 | 0.78 | ALDH1A1 (0.54) | ALDH1A1GPR35HPGDLMNAMAPT | |
| SCHEMBL3030230 | 0.77 | LCK (0.44) | NLRP3 | |
| SCHEMBL11057583 | 0.76 | SCN5A (0.46) | ALDH1A1GPR35HPGDLMNAMAPT | |
| SCHEMBL12479615 | 0.75 | MAPK1 (0.56) | ALDH1A1MAPTCYP2C19TDP1GAA | |
| SCHEMBL18398288 | 0.74 | KCNJ11 (0.37) | ALDH1A1HPGDMAPTTDP1 | |
| SCHEMBL15328457 | 0.74 | PTPN1 (0.40) | ALDH1A1TSHRCYP2C19HIF1AKDM4E | |
| SCHEMBL9193997 | 0.74 | HTT (0.35) | ALDH1A1HPGDLMNAMAPTKDM4E | |
| SCHEMBL9197167 | 0.73 | CYP1A2 (0.35) | ALDH1A1HPGDLMNAMAPTCYP2C19 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2222657-A1 | 4-PHENYLPYRANE-3,5-DIONES, 4-PHENYLTHIOPYRANE-3,5-DIONES AND 2-PHENYLCYCLOHEXANE-1,3,5-TRIONES AS HERBICIDES | Syngenta Limited (GB) | 2010-09-01 | — | — | EP | disclosed |
| WO-2009074314-A1 | 4-PHENYLPYRANE-3,5-DIONES, 4-PHENYLTHIOPYRANE-3,5-DIONES AND 2-PHENYLCYCLOHEXANE-1,3,5-TRIONES AS HERBICIDES | SYNGENTA LIMITED (GB) | 2009-06-18 | — | — | WO | disclosed |