Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 2/20 | 0.43 |
| ▸ | PAOX | Q6QHF9 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | THRA | P10827 | 1/20 | 0.34 |
| ▸ | THRB | P10828 | 1/20 | 0.34 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.33 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.33 |
| ▸ | HRH2 | P25021 | 1/20 | 0.33 |
| ▸ | HRH1 | P35367 | 1/20 | 0.33 |
| ▸ | TMEM97 | Q5BJF2 | 1/20 | 0.33 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.33 |
| ▸ | HRH3 | Q9Y5N1 | 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 | |
|---|---|---|---|---|
| SCHEMBL12773999 | 0.87 | SMN1; SMN2 (0.40) | TP53SMN1; SMN2ALDH1A1MAPTL3MBTL1 | |
| SCHEMBL12774126 | 0.86 | TP53 (0.42) | TP53SMN1; SMN2ALDH1A1MAPTL3MBTL1 | |
| SCHEMBL12881444 | 0.86 | TP53 (0.42) | TP53SMN1; SMN2ALDH1A1MAPTL3MBTL1 | |
| SCHEMBL13601613 | 0.85 | ALDH1A1 (0.41) | PAOXSMN1; SMN2ALDH1A1SIGMAR1 | |
| SCHEMBL13601525 | 0.84 | MEN1 (0.38) | SMN1; SMN2ALDH1A1MAPTMEN1KMT2A | |
| SCHEMBL13601437 | 0.83 | POLB (0.48) | TP53SMN1; SMN2ALDH1A1MAPTL3MBTL1 | |
| SCHEMBL8002029 | 0.81 | TP53 (0.49) | TP53PAOXSMN1; SMN2ALDH1A1L3MBTL1 | |
| SCHEMBL18389827 | 0.81 | PAOX (0.48) | TP53PAOXALDH1A1MAPTL3MBTL1 | |
| SCHEMBL12774157 | 0.79 | TP53 (0.36) | TP53PAOXSMN1; SMN2ALDH1A1MAPT | |
| SCHEMBL13601498 | 0.77 | DNM1 (0.49) | TP53PAOXSMN1; SMN2ALDH1A1MEN1 |
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 |
|---|---|---|---|---|---|---|---|
| US-7625886-B2 | Selected CGRP antagonists, processes for preparing them and their use as pharmaceutical compositions | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2009-12-01 | — | — | US | disclosed |