Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TACR1 | P25103 | 1/20 | 0.56 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.56 |
| ▸ | CHRM1 | P11229 | 6/20 | 0.54 |
| ▸ | UGCG | Q16739 | 8/20 | 0.51 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.50 |
| ▸ | SLC1A1 | P43005 | 1/20 | 0.49 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.47 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL2800372 | 1.00 | TACR1 (0.56) | TACR1HSD17B10CHRM1UGCGCYP3A4 | |
| SCHEMBL2801198 | 0.87 | MAPT (0.46) | TACR1HSD17B10CHRM1UGCG | |
| SCHEMBL2801202 | 0.87 | MAPT (0.46) | TACR1HSD17B10CHRM1UGCG | |
| Hydrochloric Acid SCHEMBL3791647 | 0.86 | UGCG (0.50) | TACR1UGCGCYP3A4 | |
| SCHEMBL2545138 | 0.86 | TSHR (0.57) | TACR1 | |
| Hydrochloric Acid SCHEMBL3791640 | 0.86 | UGCG (0.50) | TACR1UGCGCYP3A4 | |
| SCHEMBL2032174 | 0.86 | GRM5 (0.62) | TACR1CYP3A4SLC1A1 | |
| SCHEMBL826516 | 0.86 | GRM5 (0.62) | TACR1CYP3A4SLC1A1 | |
| Hydrochloric Acid SCHEMBL2545135 | 0.85 | TSHR (0.56) | TACR1 | |
| Hydrochloric Acid SCHEMBL2545139 | 0.85 | TSHR (0.56) | TACR1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2010091104-A1 | GLUCOSYLCERAMIDE SYNTHASE INHIBITORS | EXELIXIS, INC. (US) | 2010-08-12 | — | — | WO | disclosed |