Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.41 |
| ▸ | TSHR | P16473 | 5/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.41 |
| ▸ | RECQL | P46063 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 4/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | ALDH3A1 | P30838 | 1/20 | 0.35 |
| ▸ | HCAR3 | P49019 | 2/20 | 0.35 |
| ▸ | VCAM1 | P19320 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.34 |
| ▸ | HRH3 | Q9Y5N1 | 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 | |
|---|---|---|---|---|
| SCHEMBL7566838 | 0.79 | TSHR (0.47) | ALDH1A1TSHRCYP3A4RECQLMAPT | |
| SCHEMBL7466959 | 0.77 | TSHR (0.49) | ALDH1A1TSHRCYP3A4RECQLMAPT | |
| SCHEMBL7469818 | 0.75 | TSHR (0.47) | ALDH1A1TSHRCYP3A4RECQLMAPT | |
| SCHEMBL27457814 | 0.75 | BCL9 (0.38) | ALDH1A1TSHRCYP3A4RECQLMAPT | |
| SCHEMBL2056614 | 0.74 | TSHR (0.57) | ALDH1A1TSHRCYP3A4RECQLMAPT | |
| SCHEMBL7567175 | 0.73 | GRIA1 (0.52) | ALDH1A1TSHRCYP3A4RECQLMAPT | |
| SCHEMBL8640535 | 0.73 | TSHR (0.45) | ALDH1A1TSHRCYP3A4RECQLMAPT | |
| SCHEMBL8640530 | 0.73 | TSHR (0.45) | ALDH1A1TSHRCYP3A4RECQLMAPT | |
| SCHEMBL15173799 | 0.70 | TSHR (0.49) | ALDH1A1TSHRCYP3A4RECQLMAPT | |
| SCHEMBL2656793 | 0.69 | TSHR (0.55) | ALDH1A1TSHRCYP3A4RECQLMAPT |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0837854-A1 | ALKYL AMINE DERIVATIVES OF SUBSTITUTED QUINOXALINE 2,3-DIONES AS GLUTAMATE RECEPTOR ANTAGONISTS | WARNER-LAMBERT COMPANY (US) | 1998-04-29 | — | — | EP | disclosed |