Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B1 | P14061 | 2/20 | 0.65 |
| ▸ | HSD17B2 | P37059 | 2/20 | 0.65 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.50 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.50 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.49 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.48 |
| ▸ | PDGFRA | P16234 | 1/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | KDR | P35968 | 3/20 | 0.47 |
| ▸ | PIK3CA | P42336 | 2/20 | 0.47 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.47 |
| ▸ | PIP5K1C | O60331 | 1/20 | 0.47 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.47 |
| ▸ | PI4KA | P42356 | 1/20 | 0.47 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.47 |
| ▸ | PI4KB | Q9UBF8 | 1/20 | 0.47 |
| ▸ | MKNK1 | Q9BUB5 | 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 | |
|---|---|---|---|---|
| SCHEMBL12498936 | 0.81 | HSD17B1 (0.67) | HSD17B1HSD17B2ADORA2AADORA1CYP2A6 | |
| SCHEMBL13575386 | 0.81 | HSD17B1 (0.67) | HSD17B1HSD17B2ADORA2AADORA1CYP2A6 | |
| SCHEMBL13575381 | 0.81 | HSD17B1 (0.67) | HSD17B1HSD17B2ADORA2AADORA1CYP2A6 | |
| SCHEMBL17742850 | 0.80 | MKNK1 (0.57) | HSD17B1HSD17B2CYP2A6PDGFRBPDGFRA | |
| SCHEMBL980158 | 0.80 | HSD17B1 (0.65) | HSD17B1HSD17B2ADORA2AADORA1CYP2A6 | |
| SCHEMBL5673332 | 0.80 | HSD17B1 (0.97) | HSD17B1HSD17B2ADORA2AADORA1CYP2A6 | |
| SCHEMBL13575397 | 0.80 | HSD17B1 (0.65) | HSD17B1HSD17B2ADORA2AADORA1CYP2A6 | |
| SCHEMBL31174412 | 0.80 | CYP2A6 (0.68) | HSD17B1HSD17B2CYP2A6PDGFRBPDGFRA | |
| SCHEMBL3754419 | 0.80 | CYP2A6 (0.68) | HSD17B1HSD17B2CYP2A6PDGFRBPDGFRA | |
| SCHEMBL5714627 | 0.79 | HSD17B1 (0.63) | HSD17B1HSD17B2ADORA2AADORA1CYP2A6 |
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-3070081-A1 | BENZOTHIAZOL-6-YL ACETIC ACID DERIVATIVES AND THEIR USE FOR TREATING AN HIV INFECTION | Gilead Sciences, Inc. (US) | 2016-09-21 | — | — | EP | disclosed |
| EP-2788336-B1 | BENZOTHIAZOL-6-YL ACETIC ACID DERIVATIVES AND THEIR USE FOR TREATING AN HIV INFECTION | GILEAD SCIENCES INC (US) | 2016-03-02 | — | — | EP | disclosed |