Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.60 |
| ▸ | GAA | P10253 | 2/20 | 0.60 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.51 |
| ▸ | L3MBTL1 | Q9Y468 | 4/20 | 0.51 |
| ▸ | MAPT | P10636 | 3/20 | 0.51 |
| ▸ | POLB | P06746 | 3/20 | 0.51 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.51 |
| ▸ | LMNA | P02545 | 3/20 | 0.49 |
| ▸ | CA12 | O43570 | 2/20 | 0.46 |
| ▸ | CA1 | P00915 | 2/20 | 0.46 |
| ▸ | CA2 | P00918 | 2/20 | 0.46 |
| ▸ | CA6 | P23280 | 2/20 | 0.46 |
| ▸ | CA7 | P43166 | 2/20 | 0.46 |
| ▸ | CA13 | Q8N1Q1 | 2/20 | 0.46 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.46 |
| ▸ | NPC1 | O15118 | 2/20 | 0.46 |
| ▸ | KDM6B | O15054 | 2/20 | 0.45 |
| ▸ | KDM4A | O75164 | 2/20 | 0.45 |
| ▸ | KDM4D | Q6B0I6 | 2/20 | 0.45 |
| ▸ | KDM3B | Q7LBC6 | 2/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL9127016 | 0.87 | GAA (0.49) | ALDH1A1GAAKDM4EL3MBTL1MAPT | |
| SCHEMBL2902593 | 0.85 | ALDH1A1 (0.66) | ALDH1A1GAAKDM4EL3MBTL1MAPT | |
| SCHEMBL6706506 | 0.83 | GAA (0.63) | ALDH1A1GAAKDM4EL3MBTL1MAPT | |
| SCHEMBL23900636 | 0.83 | ALDH1A1 (0.63) | ALDH1A1GAAKDM4EL3MBTL1MAPT | |
| SCHEMBL27454468 | 0.81 | MMP2 (0.48) | ALDH1A1GAAKDM4EMAPTLMNA | |
| SCHEMBL1014580 | 0.79 | KDM4E (0.58) | ALDH1A1GAAKDM4EL3MBTL1MAPT | |
| SCHEMBL2898616 | 0.77 | GAA (0.56) | ALDH1A1GAAKDM4EL3MBTL1MAPT | |
| SCHEMBL7997265 | 0.77 | KDM4E (0.55) | ALDH1A1GAAKDM4EL3MBTL1MAPT | |
| SCHEMBL18585976 | 0.77 | ALDH1A1 (0.59) | ALDH1A1GAAKDM4EL3MBTL1MAPT | |
| SCHEMBL3824059 | 0.75 | GAA (0.54) | ALDH1A1GAAKDM4EL3MBTL1MAPT |
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-5100897-A | Hypotensive agents, congestive heart failure, ocular hypertension | MERCK & CO., INC. (US) | 1992-03-31 | — | — | US | disclosed |
| EP-0419048-A2 | Substituted pyrimidinones as angiotensin II antagonists | MERCK & CO. INC. (US) | 1991-03-27 | — | — | EP | disclosed |