Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.38 |
| ▸ | HPGD | P15428 | 2/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.38 |
| ▸ | CRHBP | P24387 | 1/20 | 0.38 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.38 |
| ▸ | AHR | P35869 | 6/20 | 0.34 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | CASP1 | P29466 | 1/20 | 0.32 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.30 |
| ▸ | HTR3B | O95264 | 1/20 | 0.30 |
| ▸ | HTR3A | P46098 | 1/20 | 0.30 |
| ▸ | HTR3D | Q70Z44 | 1/20 | 0.30 |
| ▸ | HTR3C | Q8WXA8 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL9114088 | 1.00 | ALDH1A1 (0.41) | ALDH1A1CYP3A4HPGDHSD17B10CRHBP | |
| SCHEMBL2622604 | 0.78 | ALDH1A1 (0.45) | ALDH1A1CYP3A4HPGDHSD17B10CRHBP | |
| SCHEMBL73816 | 0.76 | AHR (0.54) | ALDH1A1CYP3A4AHRTSHR | |
| SCHEMBL73815 | 0.76 | AHR (0.54) | ALDH1A1CYP3A4AHRTSHR | |
| SCHEMBL2091280 | 0.75 | ALDH1A1 (0.54) | ALDH1A1AHR | |
| SCHEMBL2091278 | 0.75 | ALDH1A1 (0.54) | ALDH1A1AHR | |
| SCHEMBL1122678 | 0.72 | ALDH1A1 (0.45) | ALDH1A1CYP3A4HPGDHSD17B10CRHBP | |
| SCHEMBL73085 | 0.70 | TRPA1 (0.41) | ALDH1A1AHR | |
| SCHEMBL73084 | 0.70 | TRPA1 (0.41) | ALDH1A1AHR | |
| SCHEMBL15128427 | 0.70 | ALDH1A1 (0.33) | ALDH1A1CYP3A4HPGDHSD17B10CRHBP |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-1114834-A | antidiabetic agent | OTSUKA PHARMA CO LTD (JP) | 1996-01-10 | — | — | CN | disclosed |
| EP-0670831-A1 | QUINOXALINE DERIVATIVE AS ANTIDIABETIC AGENT | OTSUKA PHARMACEUTICAL CO., LTD. (JP) | 1995-09-13 | — | — | EP | disclosed |
| WO-1995009159-A1 | QUINOXALINE DERIVATIVE AS ANTIDIABETIC AGENT | OTSUKA PHARMACEUTICAL COMPANY, LIMITED (JP) | 1995-04-06 | — | — | WO | disclosed |