Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HAO1 | Q9UJM8 | 1/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.50 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.50 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.50 |
| ▸ | HTT | P42858 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.48 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | MEN1 | O00255 | 3/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.47 |
| ▸ | KDM4C | Q9H3R0 | 3/20 | 0.46 |
| ▸ | KDM5A | P29375 | 2/20 | 0.46 |
| ▸ | KDM5B | Q9UGL1 | 2/20 | 0.46 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.46 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.46 |
| ▸ | TAS1R2 | Q8TE23 | 1/20 | 0.46 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.46 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.46 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.46 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.46 |
| ▸ | HTR1A | P08908 | 1/20 | 0.46 |
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 SCHEMBL15520046 | 0.98 | HAO1 (0.50) | HAO1KDM4EMAPK1MAPK14HTT | |
| SCHEMBL7251899 | 0.86 | AURKA (0.48) | HAO1MAPK1MAPK14HTTALDH1A1 | |
| SCHEMBL484230 | 0.86 | AURKA (0.48) | HAO1MAPK1MAPK14HTTALDH1A1 | |
| SCHEMBL31262393 | 0.84 | HAO1 (0.46) | HAO1KDM4EMAPK1MAPK14HTT | |
| SCHEMBL10501682 | 0.76 | ADRA2A (0.50) | HAO1MAPK1MAPK14ALDH1A1MEN1 | |
| SCHEMBL29842306 | 0.75 | GID4 (0.62) | HAO1MAPK1MAPK14ALDH1A1MEN1 | |
| SCHEMBL395087 | 0.75 | GID4 (0.62) | HAO1MAPK1MAPK14ALDH1A1MEN1 | |
| SCHEMBL2798590 | 0.75 | PIN1 (0.49) | TAS1R3TAS1R1TAS1R2ADRA1A | |
| SCHEMBL3460627 | 0.75 | PIN1 (0.49) | TAS1R3TAS1R1TAS1R2ADRA1A | |
| SCHEMBL3462221 | 0.75 | PIN1 (0.49) | TAS1R3TAS1R1TAS1R2ADRA1A |
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-2888225-A1 | ARYLALKYLAMINE COMPOUNDS AS CALCIUM SENSING RECEPTOR MODULATORS | Lupin Limited (IN) | 2015-07-01 | — | — | EP | disclosed |
| WO-2014033604-A1 | ARYLALKYLAMINE COMPOUNDS AS CALCIUM SENSING RECEPTOR MODULATORS | LUPIN LIMITED (IN) | 2014-03-06 | — | — | WO | disclosed |