Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 7/20 | 0.41 |
| ▸ | HTR2C | P28335 | 7/20 | 0.41 |
| ▸ | HTR2B | P41595 | 6/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | CA12 | O43570 | 1/20 | 0.39 |
| ▸ | CA9 | Q16790 | 1/20 | 0.39 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.37 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.37 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.37 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.37 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.36 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL862205 | 1.00 | HTR2A (0.41) | HTR2AHTR2CHTR2BMEN1CYP3A4 | |
| SCHEMBL862204 | 1.00 | HTR2A (0.41) | HTR2AHTR2CHTR2BMEN1CYP3A4 | |
| SCHEMBL2599096 | 1.00 | HTR2A (0.41) | HTR2AHTR2CHTR2BMEN1CYP3A4 | |
| SCHEMBL2764302 | 0.82 | CA12 (0.41) | MEN1CYP3A4CYP2D6KMT2ACA12 | |
| SCHEMBL11406142 | 0.75 | HTR2A (0.52) | HTR2AHTR2CHTR2BMEN1CYP3A4 | |
| SCHEMBL1891904 | 0.75 | SLC6A3 (0.44) | CHRNB2CHRNA4SLC6A3SLC6A2 | |
| SCHEMBL852627 | 0.73 | MEN1 (0.53) | HTR2AHTR2CHTR2BMEN1CYP3A4 | |
| SCHEMBL4992475 | 0.73 | ANPEP (0.53) | HTR2AMEN1CYP3A4CYP2D6KMT2A | |
| SCHEMBL13646915 | 0.72 | SRD5A1 (0.49) | SLC6A3SLC6A2 | |
| SCHEMBL3446940 | 0.72 | CHRNB4 (0.56) | HTR2AHTR2CHTR2BMEN1CYP3A4 |
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-2571353-A1 | MODULATORS OF 5-HT RECEPTORS AND METHODS OF USE THEREOF | AbbVie Inc. (US) | 2013-03-27 | — | — | EP | disclosed |
| WO-2011146089-A1 | MODULATORS OF 5-HT RECEPTORS AND METHODS OF USE THEREOF | ABBOTT LABORATORIES (US) | 2011-11-24 | — | — | WO | disclosed |