Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NAAA | Q02083 | 10/20 | 0.54 |
| ▸ | IDO1 | P14902 | 2/20 | 0.40 |
| ▸ | AGXT | P21549 | 2/20 | 0.40 |
| ▸ | REN | P00797 | 2/20 | 0.38 |
| ▸ | TACR1 | P25103 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL3049685 | 0.90 | NAAA (0.58) | NAAAIDO1AGXT | |
| SCHEMBL16685900 | 0.78 | NAAA (0.51) | NAAAIDO1AGXT | |
| SCHEMBL18855492 | 0.77 | NAAA (0.47) | NAAAIDO1AGXTRENTACR1 | |
| SCHEMBL18615761 | 0.75 | NAAA (0.54) | NAAAIDO1AGXTREN | |
| SCHEMBL24620048 | 0.74 | NAAA (0.47) | NAAAIDO1AGXTREN | |
| SCHEMBL22454181 | 0.73 | NAAA (0.56) | NAAAIDO1AGXT | |
| SCHEMBL3049370 | 0.72 | NAAA (0.43) | NAAAIDO1AGXT | |
| SCHEMBL4156986 | 0.72 | NAAA (0.46) | NAAAIDO1AGXTREN | |
| SCHEMBL14802952 | 0.72 | NAAA (0.46) | NAAAIDO1AGXTREN | |
| SCHEMBL2334154 | 0.72 | CTSL (0.57) | NAAA |
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-2747769-B1 | 2-SPIRO-SUBSTITUTED IMINOTHIAZINES AND THEIR MONO-AND DIOXIDES AS BACE INHIBITORS, COMPOSITIONS AND THEIR USE | MERCK SHARP & DOHME (US) | 2017-08-02 | — | — | EP | disclosed |
| WO-2013028670-A1 | 2-SPIRO-SUBSTITUTED IMINOTHIAZINES AND THEIR MONO-AND DIOXIDES AS BACE INHIBITORS, COMPOSITIONS AND THEIR USE | MERCK SHARP & DOHME CORP. (US) | 2013-02-28 | — | — | WO | disclosed |