Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.55 |
| ▸ | MEN1 | O00255 | 2/20 | 0.55 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.55 |
| ▸ | CTSV | O60911 | 4/20 | 0.52 |
| ▸ | CTSL | P07711 | 4/20 | 0.52 |
| ▸ | POLB | P06746 | 3/20 | 0.50 |
| ▸ | NPC1 | O15118 | 1/20 | 0.50 |
| ▸ | RAB9A | P51151 | 1/20 | 0.50 |
| ▸ | LMNA | P02545 | 1/20 | 0.50 |
| ▸ | HTT | P42858 | 1/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.50 |
| ▸ | MAPT | P10636 | 2/20 | 0.49 |
| ▸ | PDCD1 | Q15116 | 2/20 | 0.44 |
| ▸ | CD274 | Q9NZQ7 | 2/20 | 0.44 |
| ▸ | HTR1A | P08908 | 1/20 | 0.44 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.44 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.44 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.44 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.43 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL7281747 | 0.85 | MTNR1A (0.55) | ALDH1A1MEN1KMT2APOLBLMNA | |
| SCHEMBL29989715 | 0.83 | NPC1 (0.57) | ALDH1A1MEN1KMT2ANPC1RAB9A | |
| SCHEMBL5913295 | 0.83 | NPC1 (0.57) | ALDH1A1MEN1KMT2ANPC1RAB9A | |
| SCHEMBL98541 | 0.80 | SMN1; SMN2 (0.43) | ALDH1A1KMT2ANPC1RAB9ALMNA | |
| SCHEMBL7840693 | 0.80 | KDM4E (0.57) | ALDH1A1MEN1KMT2ACTSVCTSL | |
| SCHEMBL27038529 | 0.79 | POLB (0.54) | ALDH1A1MEN1KMT2ACTSVCTSL | |
| SCHEMBL5642071 | 0.79 | CTSV (0.56) | ALDH1A1MEN1KMT2ACTSVCTSL | |
| Bromide SCHEMBL11670771 | 0.79 | KDM4E (0.56) | ALDH1A1MEN1KMT2ACTSVCTSL | |
| Hydrochloric Acid SCHEMBL11669913 | 0.79 | KDM4E (0.56) | ALDH1A1MEN1KMT2ACTSVCTSL | |
| SCHEMBL7339301 | 0.78 | ALDH1A1 (0.46) | ALDH1A1POLBNPC1RAB9ALMNA |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0558677-B1 | BIOLOGICALLY ACTIVE AMINES | ASTRAZENECA AB (SE) | 2001-08-16 | — | — | EP | disclosed |
| US-5763465-A | 7-(2-aminoethyl) benzothiazolones | ASTRA PHARMACEUTICALS LIMITED (GB) | 1998-06-09 | — | — | US | disclosed |
| US-5648370-A | 7-(2-aminoethyl) benzothiazolones | ASTRA PHARMACEUTICALS LIMITED (GB) | 1997-07-15 | — | — | US | disclosed |