Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRB1 | P08588 | 3/20 | 0.47 |
| ▸ | ADRB3 | P13945 | 3/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.42 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 3/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | CA1 | P00915 | 1/20 | 0.40 |
| ▸ | CA2 | P00918 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.40 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.40 |
| ▸ | HTR1A | P08908 | 1/20 | 0.40 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL10510343 | 0.99 | ADRB1 (0.46) | ADRB1ADRB3KDM4EALDH1A1HSD17B10 | |
| SCHEMBL10810023 | 0.87 | ADRB1 (0.44) | ADRB1ADRB3KDM4EALDH1A1HSD17B10 | |
| SCHEMBL10808764 | 0.86 | ADRB1 (0.49) | ADRB1ADRB3KDM4EALDH1A1HSD17B10 | |
| Hydrochloric Acid SCHEMBL10508493 | 0.85 | ADRB1 (0.43) | ADRB1ADRB3KDM4EALDH1A1HSD17B10 | |
| Hydrochloric Acid SCHEMBL10508096 | 0.85 | ADRB1 (0.48) | ADRB1ADRB3KDM4EALDH1A1HSD17B10 | |
| Hydrochloric Acid SCHEMBL10818347 | 0.85 | ADRB1 (0.48) | ADRB1ADRB3KDM4EALDH1A1HSD17B10 | |
| SCHEMBL9787263 | 0.84 | GAA (0.53) | ADRB1ADRB3ALDH1A1MEN1KMT2A | |
| SCHEMBL9787273 | 0.84 | GAA (0.53) | ADRB1ADRB3ALDH1A1MEN1KMT2A | |
| SCHEMBL10812044 | 0.80 | ADRB3 (0.52) | ADRB1ADRB3CYP3A4ADRB2CYP2D6 | |
| SCHEMBL10822520 | 0.79 | ADRB3 (0.46) | ADRB1ADRB3KDM4EALDH1A1HSD17B10 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0142102-B1 | TERTIARY AMINES | BEECHAM GROUP PLC (GB) | 1987-09-23 | — | — | EP | claimed |
| EP-0142102-A2 | Tertiary amines | BEECHAM GROUP PLC (GB) | 1985-05-22 | — | — | EP | claimed |