Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CASP1 | P29466 | 2/20 | 0.37 |
| ▸ | RAB9A | P51151 | 2/20 | 0.33 |
| ▸ | GLA | P06280 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 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 | |
|---|---|---|---|---|
| SCHEMBL9740373 | 0.90 | CASP1 (0.33) | CASP1SMN1; SMN2ALDH1A1 | |
| SCHEMBL9736565 | 0.78 | NPSR1 (0.36) | SMN1; SMN2ALDH1A1 | |
| SCHEMBL11251517 | 0.76 | ALDH1A1 (0.37) | CASP1RAB9AGLAGAAHTT | |
| SCHEMBL9735726 | 0.76 | FAAH (0.31) | SMN1; SMN2 | |
| SCHEMBL10862091 | 0.74 | PKM (0.37) | CASP1GAASMN1; SMN2ALDH1A1 | |
| SCHEMBL10378728 | 0.74 | CASP1 (0.37) | CASP1RAB9AGLAGAAHTT | |
| SCHEMBL10420401 | 0.74 | CASP1 (0.37) | CASP1 | |
| SCHEMBL13969328 | 0.73 | PKM (0.37) | CASP1GAASMN1; SMN2ALDH1A1 | |
| SCHEMBL12442504 | 0.70 | PKM (0.35) | SMN1; SMN2ALDH1A1 | |
| SCHEMBL13946279 | 0.70 | PKM (0.35) | SMN1; SMN2ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| US-5138050-A | 6-amido-1-methyl carbapenems | MERCK & CO., INC. (US) | 1992-08-11 | — | — | US | disclosed |
| WO-1990000170-A1 | NOVEL 6-AMIDO-1-METHYLCARBAPENEMS | MERCK & CO., INC. (US) | 1990-01-11 | — | — | WO | disclosed |