Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NAAA | Q02083 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | DPP4 | P27487 | 2/20 | 0.37 |
| ▸ | HDAC3 | O15379 | 3/20 | 0.35 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.35 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.35 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.35 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.34 |
| ▸ | HRH2 | P25021 | 2/20 | 0.33 |
| ▸ | HRH1 | P35367 | 2/20 | 0.33 |
| ▸ | NAMPT | P43490 | 2/20 | 0.33 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.33 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL10305153 | 0.86 | NAAA (0.45) | NAAAALDH1A1POLBMAPTDPP4 | |
| SCHEMBL10305190 | 0.86 | NAAA (0.45) | NAAAALDH1A1POLBMAPTDPP4 | |
| Hydrochloric Acid SCHEMBL4205496 | 0.85 | NAAA (0.44) | NAAAALDH1A1POLBMAPTDPP4 | |
| Hydrochloric Acid SCHEMBL4215619 | 0.85 | NAAA (0.44) | NAAAALDH1A1POLBMAPTDPP4 | |
| SCHEMBL13374258 | 0.84 | NAAA (0.43) | NAAAALDH1A1POLBMAPTDPP4 | |
| Hydrochloric Acid SCHEMBL4208689 | 0.84 | NAAA (0.42) | NAAAALDH1A1POLBMAPTDPP4 | |
| SCHEMBL14303384 | 0.81 | ALDH1A1 (0.40) | ALDH1A1DPP4CHRM1KMT2ASMN1; SMN2 | |
| SCHEMBL16938513 | 0.76 | UGCG (0.42) | ALDH1A1MAPTHPGDMEN1KMT2A | |
| SCHEMBL10305158 | 0.74 | HRH2 (0.46) | NAAAALDH1A1HDAC3HDAC1HDAC2 | |
| SCHEMBL10305169 | 0.73 | UGCG (0.53) | ALDH1A1MAPTHPGDMEN1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| EP-1841743-B1 | 3-Aryl-3-hydroxy-2-amino-propionic acid amides, 3-heteroaryl-3-hydroxy-2-amino-propionic acid amides and related compounds having analgesic and/or immuno stimulant activity | ALLERGAN INC (US) | 2016-01-20 | — | — | EP | disclosed |