Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.40 |
| ▸ | TSHR | P16473 | 3/20 | 0.40 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.39 |
| ▸ | HSP90B1 | P14625 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 3/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.39 |
| ▸ | RAB9A | P51151 | 2/20 | 0.39 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.39 |
| ▸ | OPRK1 | P41145 | 2/20 | 0.38 |
| ▸ | HTT | P42858 | 3/20 | 0.38 |
| ▸ | LMNA | P02545 | 4/20 | 0.38 |
| ▸ | GLA | P06280 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.35 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL10690564 | 0.78 | TSHR (0.41) | ALDH1A1TSHRHSP90AA1HSP90B1MAPT | |
| SCHEMBL27528035 | 0.78 | HSP90AA1 (0.46) | ALDH1A1TSHRHSP90AA1HSP90B1MAPT | |
| SCHEMBL9638042 | 0.76 | HSD17B10 (0.51) | ALDH1A1TSHRHSP90AA1HTTLMNA | |
| SCHEMBL10556011 | 0.75 | HSP90AA1 (0.47) | ALDH1A1TSHRHSP90AA1HSP90B1L3MBTL1 | |
| SCHEMBL10691914 | 0.74 | HSP90AA1 (0.41) | ALDH1A1TSHRHSP90AA1HSP90B1L3MBTL1 | |
| SCHEMBL28420210 | 0.73 | HSP90AA1 (0.45) | ALDH1A1TSHRHSP90AA1HSP90B1L3MBTL1 | |
| SCHEMBL10555867 | 0.72 | HSP90AA1 (0.42) | ALDH1A1TSHRHSP90AA1HSP90B1L3MBTL1 | |
| SCHEMBL10555876 | 0.72 | HSP90AA1 (0.44) | ALDH1A1TSHRHSP90AA1HSP90B1L3MBTL1 | |
| SCHEMBL10556844 | 0.72 | HSP90AA1 (0.40) | ALDH1A1TSHRHSP90AA1HSP90B1L3MBTL1 | |
| SCHEMBL10780466 | 0.71 | ALDH1A1 (0.42) | ALDH1A1TSHRHSP90AA1HSP90B1MAPT |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0301456-B1 | Novel (aryl or heteroaromatic methyl)-2,2'-BI-1H-imidazoles | MERRELL DOW PHARMA (US) | 1994-02-02 | — | — | EP | disclosed |
| US-5017591-A | Enzyme inhibitors | MERRELL DOW PHARMACEUTICALS (US) | 1991-05-21 | — | — | US | disclosed |
| US-4929744-A | DEHYDROHALOGENATION, SODIUM HYDROXIDE BASE, ETHANOL SOLVENT | MERRELL DOW PHARMACEUTICALS (US) | 1990-05-29 | — | — | US | disclosed |
| US-4839375-A | (Aryl or heteroaromatic methyl)-2,2'-bi-1H-imidazoles and their use as anti-hypertensive agents | MERRELL DOW PHARMACEUTICALS INC. (US) | 1989-06-13 | — | — | US | disclosed |
| US-4810800-A | HYPOTENSIVE AGENTS | MERRELL DOW PHARMACEUTICALS INC. (US) | 1989-03-07 | — | — | US | disclosed |
| EP-0301456-A2 | Novel (aryl or heteroaromatic methyl)-2,2'-BI-1H-imidazoles | MERRELL DOW PHARMACEUTICALS INC. (US) | 1989-02-01 | — | — | EP | disclosed |