Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LNPEP | Q9UIQ6 | 6/20 | 0.40 |
| ▸ | ERAP2 | Q6P179 | 1/20 | 0.40 |
| ▸ | ERAP1 | Q9NZ08 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | LTA4H | P09960 | 1/20 | 0.38 |
| ▸ | LAP3 | P28838 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.37 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | CA12 | O43570 | 1/20 | 0.36 |
| ▸ | CA1 | P00915 | 1/20 | 0.36 |
| ▸ | CA2 | P00918 | 1/20 | 0.36 |
| ▸ | CA9 | Q16790 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.35 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.35 |
| ▸ | HDAC3 | O15379 | 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 | |
|---|---|---|---|---|
| SCHEMBL27783442 | 0.81 | FFAR4 (0.44) | LTA4HLAP3 | |
| SCHEMBL27643536 | 0.80 | HTR1A (0.40) | ALDH1A1MAPK1L3MBTL1KMT2ARAB9A | |
| SCHEMBL27608010 | 0.79 | ENPP2 (0.53) | SLC6A2SLC6A3CA12CA1CA2 | |
| SCHEMBL27643798 | 0.79 | KLK8 (0.35) | ALDH1A1LTA4HLAP3MAPK1L3MBTL1 | |
| SCHEMBL27689662 | 0.79 | KMT2A (0.41) | ALDH1A1LTA4HLAP3MAPK1L3MBTL1 | |
| SCHEMBL27767610 | 0.78 | ALDH1A1 (0.46) | ALDH1A1LTA4HLAP3MAPK1L3MBTL1 | |
| SCHEMBL27486547 | 0.76 | ALDH1A1 (0.44) | ALDH1A1LTA4HMAPK1L3MBTL1SLC6A2 | |
| SCHEMBL24405140 | 0.76 | TDP1 (0.54) | ALDH1A1MAPK1L3MBTL1SLC6A2SLC6A3 | |
| SCHEMBL27548402 | 0.75 | ALDH1A1 (0.49) | ALDH1A1LTA4HLAP3MAPK1L3MBTL1 | |
| SCHEMBL27371886 | 0.75 | ALDH1A1 (0.49) | ALDH1A1LTA4HLAP3MAPK1L3MBTL1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-100558728-C | Calcitonin gene related peptide receptor antagonists | BRISTOL MYERS SQUIBB CO (US) | 2009-11-11 | — | — | CN | disclosed |
| CN-1671711-A | Calcitonin gene related peptide receptor antagonists | BRISTOL MYERS SQUIBB CO (US) | 2005-09-21 | — | — | CN | disclosed |