Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | USP2 | O75604 | 1/20 | 0.38 |
| ▸ | TERT | O14746 | 3/20 | 0.35 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.35 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.35 |
| ▸ | USP14 | P54578 | 3/20 | 0.33 |
| ▸ | USP5 | P45974 | 1/20 | 0.33 |
| ▸ | USP7 | Q93009 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | MAOA | P21397 | 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 | |
|---|---|---|---|---|
| SCHEMBL11315914 | 0.80 | GRIN1 (0.38) | ALDH1A1GRIN1GRIN2BHTTSMN1; SMN2 | |
| SCHEMBL24331648 | 0.79 | ALDH1A1 (0.50) | ALDH1A1HTTSMN1; SMN2 | |
| SCHEMBL12640379 | 0.79 | ALDH1A1 (0.41) | ALDH1A1USP2TERTUSP14USP5 | |
| SCHEMBL11271064 | 0.79 | KDM4E (0.47) | ALDH1A1SMN1; SMN2 | |
| SCHEMBL11269504 | 0.78 | ALDH1A1 (0.53) | ALDH1A1HTTSMN1; SMN2 | |
| SCHEMBL27650078 | 0.74 | KDM4E (0.37) | ALDH1A1USP2TERTHTT | |
| SCHEMBL20327046 | 0.74 | KDM4E (0.53) | ALDH1A1HTTSMN1; SMN2 | |
| SCHEMBL8902965 | 0.73 | USP2 (0.42) | ALDH1A1USP2TERTUSP14USP5 | |
| SCHEMBL167007 | 0.73 | HSD17B10 (0.50) | ALDH1A1USP2TERT | |
| SCHEMBL21983188 | 0.72 | ALDH1A1 (0.40) | ALDH1A1USP2TERTUSP14USP5 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4316903-A | BACTERICIDES AND FUNGICIDES | MERCK & CO., INC. (US) | 1982-02-23 | — | — | US | claimed |
| US-4316903-A | BACTERICIDES AND FUNGICIDES | MERCK & CO., INC. (US) | 1982-02-23 | — | — | US | disclosed |
| US-4273781-A | Treatment of pain, fever, and inflammation with compositions containing piperidinobutan-and 3-buten-2-ones | MERCK & CO., INC. (US) | 1981-06-16 | — | — | US | disclosed |
| US-4250184-A | ANTIARTHRITIC AGENTS; SKIN DISORDERS; GOUT; RHEUMATIC DISEASES | MERCK & CO., INC. (US) | 1981-02-10 | — | — | US | disclosed |
| US-4145426-A | FUNGICIDES, BACTERICIDES | MERCK & CO., INC. (US) | 1979-03-20 | — | — | US | disclosed |