Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.35 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | HPGD | P15428 | 2/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | PTGDR2 | Q9Y5Y4 | 2/20 | 0.33 |
| ▸ | GSK3B | P49841 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.32 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.32 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.30 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.30 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.30 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL2655191 | 0.74 | PTGDR2 (0.40) | ALDH1A1MEN1KMT2APTGDR2KEAP1 | |
| SCHEMBL7042949 | 0.70 | ALDH1A1 (0.32) | ALDH1A1MEN1KMT2AHPGDSMN1; SMN2 | |
| SCHEMBL28007558 | 0.68 | THRB (0.34) | ALDH1A1MEN1KMT2APTGDR2MAPT | |
| SCHEMBL7904931 | 0.67 | ALDH1A1 (0.35) | ALDH1A1MEN1KMT2AHPGDSMN1; SMN2 | |
| SCHEMBL22615007 | 0.65 | ALDH1A1 (0.57) | ALDH1A1MEN1KMT2AHPGDHTT | |
| SCHEMBL27565970 | 0.63 | GABRA5 (0.42) | ALDH1A1MEN1KMT2AHPGDPTGDR2 | |
| SCHEMBL5797600 | 0.62 | CA2 (0.33) | — | |
| SCHEMBL827254 | 0.62 | GSK3B (0.52) | ALDH1A1MEN1KMT2AHPGDSMN1; SMN2 | |
| SCHEMBL18301798 | 0.62 | BCAT2 (0.57) | MEN1KMT2ASMN1; SMN2KEAP1AKR1B1 | |
| SCHEMBL19178089 | 0.62 | KEAP1 (0.42) | MEN1KMT2AMAPTKEAP1NFE2L2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0904079-B1 | ANTIDIABETIC AGENTS | MERCK & CO INC (US) | 2004-03-24 | — | — | EP | disclosed |
| EP-0904079-A4 | — | — | 1999-05-06 | — | — | EP | disclosed |
| EP-0904079-A1 | ANTIDIABETIC AGENTS | Merck & Co., Inc. (US) | 1999-03-31 | — | — | EP | disclosed |
| US-5859051-A | ACETYLPHENOL DERIVATIVES | MERCK & CO., INC. (US) | 1999-01-12 | — | — | US | disclosed |
| WO-1997027857-A1 | ANTIDIABETIC AGENTS | MERCK & CO., INC. (US) | 1997-08-07 | — | — | WO | disclosed |