Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC7A5 | Q01650 | 7/20 | 0.48 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.48 |
| ▸ | USP2 | O75604 | 1/20 | 0.48 |
| ▸ | EGFR | P00533 | 1/20 | 0.48 |
| ▸ | LCK | P06239 | 1/20 | 0.48 |
| ▸ | FYN | P06241 | 1/20 | 0.48 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.48 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.48 |
| ▸ | HTR2A | P28223 | 1/20 | 0.48 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.48 |
| ▸ | RECQL | P46063 | 1/20 | 0.48 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.48 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.48 |
| ▸ | TYR | P14679 | 5/20 | 0.45 |
| ▸ | GRIA2 | P42262 | 2/20 | 0.44 |
| ▸ | GRIK1 | P39086 | 1/20 | 0.44 |
| ▸ | GRIA1 | P42261 | 1/20 | 0.44 |
| ▸ | GRIA3 | P42263 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL11602211 | 0.99 | SLC7A5 (0.47) | SLC7A5PTGS1KDM4EUSP2EGFR | |
| SCHEMBL11600601 | 0.90 | SLC7A5 (0.48) | SLC7A5PTGS1KDM4EUSP2EGFR | |
| Hydrochloric Acid SCHEMBL11600341 | 0.88 | SLC7A5 (0.47) | SLC7A5PTGS1KDM4EUSP2EGFR | |
| SCHEMBL11601080 | 0.78 | SLC7A5 (0.53) | SLC7A5PTGS1KDM4EUSP2EGFR | |
| SCHEMBL3922722 | 0.77 | LMNA (0.51) | HTR2APKMLMNAMAOB | |
| SCHEMBL16174315 | 0.77 | LMNA (0.51) | HTR2ALMNAMAOB | |
| Hydrochloric Acid SCHEMBL11599540 | 0.77 | SLC7A5 (0.51) | SLC7A5PTGS1KDM4EUSP2EGFR | |
| SCHEMBL11602613 | 0.75 | MAPT (0.51) | KDM4EUSP2EGFRFYNALOX15 | |
| SCHEMBL13675019 | 0.75 | LMNA (0.53) | HTR2ALMNAMAOB | |
| SCHEMBL11603982 | 0.75 | GRIA2 (0.61) | SLC7A5PTGS1KDM4EUSP2EGFR |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4073929-A | HYPOTENSIVE AGENTS | MERCK & CO., INC. (US) | 1978-02-14 | — | — | US | disclosed |
| US-4069333-A | 2-HYDRAZINO-3-PHENYLPROPIONIC ACID DECARBOXYLASE INHIBITORS, BENZOXAZOLE ANALINES | MERCK & CO., INC. (US) | 1978-01-17 | — | — | US | disclosed |
| US-4051251-A | DECARBOXYLASE INHIBITOR, BENZIMIDAZOLE AND BENZOXAZOLE ALANINES N | MERCK & CO., INC. (US) | 1977-09-27 | — | — | US | disclosed |