Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 5/20 | 0.46 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 3/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | HRH1 | P35367 | 5/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 2/20 | 0.39 |
| ▸ | CACNA1H | O95180 | 1/20 | 0.39 |
| ▸ | CACNA2D1 | P54289 | 1/20 | 0.39 |
| ▸ | CACNA1B | Q00975 | 1/20 | 0.39 |
| ▸ | CACNB1 | Q02641 | 1/20 | 0.39 |
| ▸ | CACNA1C | Q13936 | 1/20 | 0.39 |
| ▸ | GABBR2 | O75899 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL11715129 | 0.80 | HPGD (0.45) | HTR2ATAAR1LMNAPOLBHRH1 | |
| SCHEMBL19381474 | 0.78 | TAAR1 (0.52) | TAAR1POLBALDH1A1CYP2C19HPGD | |
| SCHEMBL12696368 | 0.78 | SCN4A (0.45) | HTR2ATAAR1LMNACYP2C19 | |
| SCHEMBL1334625 | 0.77 | LMNA (0.46) | LMNAPOLBALDH1A1KDM4EL3MBTL1 | |
| SCHEMBL14536469 | 0.75 | HRH1 (0.50) | HTR2ATAAR1LMNAHRH1ALDH1A1 | |
| SCHEMBL3409312 | 0.74 | HMOX2 (0.53) | HTR2ATAAR1LMNAPOLBCYP2C19 | |
| 3,3-Diphenylpropanoic Acid SCHEMBL5283373 | 0.74 | GABBR2 (0.59) | LMNAPOLBMAPTCYP2C19HPGD | |
| SCHEMBL29137510 | 0.74 | HPGD (0.47) | HTR2ATAAR1LMNAPOLBHRH1 | |
| SCHEMBL1537247 | 0.74 | CA12 (0.47) | HTR2ATAAR1LMNAPOLBHRH1 | |
| 3,3-Diphenylpropanoic Acid SCHEMBL66473 | 0.74 | GABBR2 (0.59) | LMNAPOLBMAPTCYP2C19HPGD |
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 |
|---|---|---|---|---|---|---|---|
| WO-2004089377-A1 | CALCIUM CHANNEL BLOCKERS COMPRISING TWO BENZHYDRIL MOIETIES | NEUROMED TECHNOLOGIES, INC. (CA) | 2004-10-21 | — | — | WO | disclosed |