Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | AADAT | Q8N5Z0 | 1/20 | 0.37 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.36 |
| ▸ | SLC6A2 | P23975 | 3/20 | 0.36 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.36 |
| ▸ | SLC6A3 | Q01959 | 3/20 | 0.36 |
| ▸ | HTR2A | P28223 | 1/20 | 0.36 |
| ▸ | HTR2C | P28335 | 1/20 | 0.36 |
| ▸ | HTR2B | P41595 | 1/20 | 0.36 |
| ▸ | SRD5A1 | P18405 | 5/20 | 0.33 |
| ▸ | HSD17B3 | P37058 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL12905300 | 0.80 | ALDH1A1 (0.47) | HSD17B10ALDH1A1AADATNOTUMHTR2A | |
| SCHEMBL5984538 | 0.73 | METAP1 (0.42) | HSD17B10ALDH1A1HTR2AHTR2CHTR2B | |
| SCHEMBL112127 | 0.72 | HSD17B10 (0.42) | HSD17B10ALDH1A1AADATNOTUMHTR2A | |
| SCHEMBL12905302 | 0.72 | NOTUM (0.53) | ALDH1A1NOTUMHTR2AHTR2CSRD5A1 | |
| SCHEMBL14612528 | 0.71 | ALDH1A1 (0.43) | ALDH1A1NOTUMSLC6A2SLC6A4SLC6A3 | |
| SCHEMBL23966392 | 0.70 | KCNH2 (0.37) | HSD17B10ALDH1A1AADATNOTUMSLC6A2 | |
| SCHEMBL5986406 | 0.69 | METAP1 (0.42) | HSD17B10ALDH1A1NOTUMHTR2AHTR2C | |
| SCHEMBL5987698 | 0.69 | HSD17B10 (0.44) | HSD17B10ALDH1A1AADATSRD5A1 | |
| SCHEMBL2835665 | 0.67 | SLC6A2 (0.49) | ALDH1A1SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL2625792 | 0.67 | ALDH1A1 (0.50) | HSD17B10ALDH1A1AADATNOTUMSRD5A1 |
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-3517536-B1 | AMINOTRIAZINE DERIVATIVES USEFUL AS TANK-BINDING KINASE INHIBITOR COMPOUNDS | GILEAD SCIENCES INC (US) | 2021-05-05 | — | — | EP | disclosed |