Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | MT-CO2 | P00403 | 1/20 | 0.36 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.36 |
| ▸ | MAPK14 | Q16539 | 2/20 | 0.35 |
| ▸ | CCR5 | P51681 | 1/20 | 0.35 |
| ▸ | PTGER1 | P34995 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | NCOA3 | Q9Y6Q9 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL11381503 | 0.88 | CYP19A1 (0.37) | ALDH1A1MAPK14CCR5PTGER1MEN1 | |
| SCHEMBL8601015 | 0.77 | MEN1 (0.44) | ALDH1A1CCR5L3MBTL1MEN1KMT2A | |
| SCHEMBL17542808 | 0.77 | CHRM5 (0.39) | ALDH1A1POLBLMNAL3MBTL1MEN1 | |
| SCHEMBL17543630 | 0.76 | HCRTR1 (0.38) | ALDH1A1POLBL3MBTL1MEN1KMT2A | |
| SCHEMBL9097263 | 0.75 | MAPK14 (0.44) | ALDH1A1POLBMAPK14LMNASMN1; SMN2 | |
| SCHEMBL8601204 | 0.73 | CCR5 (0.45) | ALDH1A1CCR5L3MBTL1MEN1KMT2A | |
| SCHEMBL27252708 | 0.71 | MAPT (0.44) | ALDH1A1CCR5SMN1; SMN2L3MBTL1MEN1 | |
| SCHEMBL8601010 | 0.69 | LMNA (0.46) | LMNASMN1; SMN2L3MBTL1MEN1KMT2A | |
| SCHEMBL17543494 | 0.69 | MAOA (0.36) | CCR5PTGER1 | |
| SCHEMBL98551 | 0.69 | FFAR1 (0.42) | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4302588-A | 5-(3-SUBSTITUTED AMINO)-2-HYDROXY-PROPYLOXY)-8-HYDROXY OR ALKOXY-CARBOSTYRILS, ADRENERGIC BLOCKING AGENTS | OTSUKA PHARMACEUTICAL CO., LTD. (JP) | 1981-11-24 | — | — | US | disclosed |