Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | GLA | P06280 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 4/20 | 0.36 |
| ▸ | RAB9A | P51151 | 4/20 | 0.36 |
| ▸ | NPC1 | O15118 | 3/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.36 |
| ▸ | CYP26A1 | O43174 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | CTSK | P43235 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | FAAH | O00519 | 1/20 | 0.34 |
| ▸ | HRH3 | Q9Y5N1 | 4/20 | 0.34 |
| ▸ | HRH4 | Q9H3N8 | 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 | |
|---|---|---|---|---|
| SCHEMBL5500079 | 0.78 | L3MBTL1 (0.40) | SMN1; SMN2L3MBTL1MAPK1HPGDRAB9A | |
| SCHEMBL4759543 | 0.75 | ITGB3 (0.40) | SMN1; SMN2L3MBTL1MAPK1ALDH1A1GLA | |
| SCHEMBL3663114 | 0.74 | L3MBTL1 (0.43) | SMN1; SMN2L3MBTL1MAPK1ALDH1A1HPGD | |
| SCHEMBL5086318 | 0.74 | FAAH (0.45) | SMN1; SMN2L3MBTL1MAPK1ALDH1A1KMT2A | |
| SCHEMBL4686872 | 0.74 | HRH3 (0.39) | SMN1; SMN2L3MBTL1HPGDRAB9ANPC1 | |
| SCHEMBL6015437 | 0.74 | ESR1 (0.41) | SMN1; SMN2L3MBTL1MAPK1ALDH1A1GLA | |
| SCHEMBL5085765 | 0.73 | SMN1; SMN2 (0.50) | SMN1; SMN2L3MBTL1MAPK1HPGDRAB9A | |
| SCHEMBL844472 | 0.73 | SMN1; SMN2 (0.57) | SMN1; SMN2L3MBTL1MAPK1ALDH1A1HPGD | |
| SCHEMBL14040614 | 0.73 | SMN1; SMN2 (0.57) | SMN1; SMN2L3MBTL1MAPK1ALDH1A1HPGD | |
| SCHEMBL5085784 | 0.72 | CYP26A1 (0.53) | SMN1; SMN2L3MBTL1MAPK1HPGDRAB9A |
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-1981854-A1 | ARYLPROPIONAMIDE, ARYLACRYLAMIDE, ARYLPROPYNAMIDE, OR ARYLMETHYLUREA ANALOGS AS FACTOR XIA INHIBITORS | Brystol-Myers Squibb Company (US) | 2008-10-22 | — | — | EP | disclosed |
| WO-2007070826-A1 | ARYLPROPIONAMIDE, ARYLACRYLAMIDE, ARYLPROPYNAMIDE, OR ARYLMETHYLUREA ANALOGS AS FACTOR XIA INHIBITORS | BRISTOL-MYERS SQUIBB COMPANY (US) | 2007-06-21 | — | — | WO | disclosed |