Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR3A | P46098 | 2/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.33 |
| ▸ | TP53 | P04637 | 3/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | USP2 | O75604 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 2/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.32 |
| ▸ | HTR3B | O95264 | 1/20 | 0.32 |
| ▸ | HTR3D | Q70Z44 | 1/20 | 0.32 |
| ▸ | HTR3C | Q8WXA8 | 1/20 | 0.32 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.30 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL1497889 | 0.82 | ALDH1A1 (0.42) | ALDH1A1TP53SMN1; SMN2NPC1USP2 | |
| SCHEMBL1497977 | 0.79 | HTR3A (0.72) | HTR3ACYP3A4ALDH1A1TP53SMN1; SMN2 | |
| SCHEMBL1497859 | 0.78 | ALDH1A1 (0.40) | ALDH1A1TP53SMN1; SMN2NPC1USP2 | |
| SCHEMBL1497787 | 0.78 | HTR3A (0.61) | HTR3ACYP3A4ALDH1A1TP53SMN1; SMN2 | |
| SCHEMBL1497874 | 0.76 | ALDH1A1 (0.40) | HTR3ACYP3A4ALDH1A1TP53SMN1; SMN2 | |
| SCHEMBL1497788 | 0.73 | HTR3A (0.62) | HTR3ACYP3A4ALDH1A1TP53SMN1; SMN2 | |
| SCHEMBL1497720 | 0.72 | PDE10A (0.39) | HTR3ACYP3A4ALDH1A1TP53SMN1; SMN2 | |
| SCHEMBL1497701 | 0.71 | ALDH1A1 (0.36) | ALDH1A1SMN1; SMN2USP2NPSR1POLB | |
| SCHEMBL1497698 | 0.71 | CNR1 (0.48) | HTR3ACYP3A4MEN1KMT2AHTR3E | |
| SCHEMBL1497936 | 0.70 | HTR3A (0.58) | HTR3ACYP3A4ALDH1A1TP53SMN1; SMN2 |
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-1829543-B1 | Preventive agent/remedial agent for constipation predominant IBS | MITSUBISHI TANABE PHARMA CORP (JP) | 2009-01-21 | — | — | EP | disclosed |
| EP-1829543-A1 | Preventive agent/remedial agent for constipation predominant IBS | MITSUBISHI PHARMA CORPORATION (JP) | 2007-09-05 | — | — | EP | disclosed |