Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | AHR | P35869 | 1/20 | 0.31 |
| ▸ | HPGD | P15428 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.31 |
| ▸ | ERN1 | O75460 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 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 | |
|---|---|---|---|---|
| SCHEMBL5070145 | 0.98 | ALDH1A1 (0.38) | ALDH1A1AHRHPGDTSHRHSD17B10 | |
| SCHEMBL7282307 | 0.97 | ALDH1A1 (0.37) | ALDH1A1AHRHPGDTSHRHSD17B10 | |
| SCHEMBL5069257 | 0.77 | ALDH1A1 (0.45) | ALDH1A1MAPT | |
| SCHEMBL6049601 | 0.74 | PNMT (0.43) | ALDH1A1TSHR | |
| SCHEMBL8894567 | 0.74 | — | — | |
| SCHEMBL8897584 | 0.72 | — | — | |
| SCHEMBL7273201 | 0.72 | ERN1 (0.34) | TSHRERN1 | |
| SCHEMBL16093967 | 0.68 | KDM4E (0.43) | ALDH1A1HPGDERN1 | |
| SCHEMBL5073554 | 0.68 | ALDH1A1 (0.35) | ALDH1A1AHRHPGDTSHRHSD17B10 | |
| SCHEMBL11788286 | 0.66 | GABRA1 (0.37) | ALDH1A1AHRHPGDTSHRHSD17B10 |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0372934-B1 | Pharmacologically active CNS compounds | WELLCOME FOUND (GB) | 1996-10-23 | — | — | EP | disclosed |
| EP-0459819-B1 | Pharmacologically active CNS compound | WELLCOME FOUND (GB) | 1996-08-14 | — | — | EP | disclosed |
| CN-1117046-A | Method for preparing pharmaceutically active CNS compounds | WELLCOME FOUND (GB) | 1996-02-21 | — | — | CN | disclosed |
| CN-1113487-A | Method for preparing pharmaceutically active CNS compounds | WELLCOME FOUND (GB) | 1995-12-20 | — | — | CN | disclosed |
| EP-0679645-A1 | Pharmacologically active CNS pyridmidin compounds | THE WELLCOME FOUNDATION LIMITED (GB) | 1995-11-02 | — | — | EP | disclosed |
| EP-0459819-A2 | Pharmacologically active CNS compound | THE WELLCOME FOUNDATION LIMITED (GB) | 1991-12-04 | — | — | EP | disclosed |
| CN-1052306-A | Compounds having pharmacological activity on the central nervous system | WELLCOME FOUND (GB) | 1991-06-19 | — | — | CN | disclosed |