Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | TSHR | P16473 | 2/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | DNM1 | Q05193 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | HRH3 | Q9Y5N1 | 3/20 | 0.36 |
| ▸ | DRD3 | P35462 | 1/20 | 0.36 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.36 |
| ▸ | PAOX | Q6QHF9 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL13601611 | 0.90 | CHRM2 (0.43) | ALDH1A1TSHRSMN1; SMN2DNM1GAA | |
| SCHEMBL12772770 | 0.87 | GNAI3 (0.38) | ALDH1A1TSHRSMN1; SMN2L3MBTL1MEN1 | |
| SCHEMBL12772789 | 0.87 | L3MBTL1 (0.37) | ALDH1A1TSHRSMN1; SMN2L3MBTL1MEN1 | |
| SCHEMBL12881643 | 0.87 | SMN1; SMN2 (0.34) | ALDH1A1TSHRSMN1; SMN2L3MBTL1MEN1 | |
| SCHEMBL12881665 | 0.87 | SMN1; SMN2 (0.34) | ALDH1A1TSHRSMN1; SMN2L3MBTL1MEN1 | |
| SCHEMBL12772809 | 0.87 | BDKRB1 (0.37) | ALDH1A1TSHRSMN1; SMN2L3MBTL1MEN1 | |
| SCHEMBL13601506 | 0.86 | DNM1 (0.43) | ALDH1A1TSHRSMN1; SMN2L3MBTL1MEN1 | |
| SCHEMBL12881699 | 0.85 | TSHR (0.35) | ALDH1A1TSHRSMN1; SMN2L3MBTL1MEN1 | |
| SCHEMBL10852328 | 0.82 | THRA (0.47) | ALDH1A1TSHRSMN1; SMN2L3MBTL1MEN1 | |
| SCHEMBL13601375 | 0.82 | NPC1 (0.39) | ALDH1A1TSHRSMN1; SMN2L3MBTL1MEN1 |
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 |