Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1C3 | P42330 | 6/20 | 0.71 |
| ▸ | HRH4 | Q9H3N8 | 5/20 | 0.67 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.65 |
| ▸ | POLB | P06746 | 1/20 | 0.64 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.64 |
| ▸ | RBP4 | P02753 | 1/20 | 0.60 |
| ▸ | DRD3 | P35462 | 2/20 | 0.56 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.56 |
| ▸ | HTR1A | P08908 | 1/20 | 0.56 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.56 |
| ▸ | HTR2B | P41595 | 1/20 | 0.56 |
| ▸ | TMEM97 | Q5BJF2 | 1/20 | 0.56 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.56 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.56 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.56 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.56 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.56 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.56 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.56 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.56 |
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 | |
|---|---|---|---|---|
| SCHEMBL11981458 | 0.83 | AKR1C3 (1.00) | AKR1C3HRH4HRH3POLBSMN1; SMN2 | |
| SCHEMBL23493748 | 0.83 | AKR1C3 (0.52) | AKR1C3HRH4HRH3POLBSMN1; SMN2 | |
| SCHEMBL12803717 | 0.83 | AKR1C3 (0.67) | AKR1C3HRH4HRH3POLBSMN1; SMN2 | |
| SCHEMBL2350768 | 0.82 | HRH4 (0.78) | AKR1C3HRH4HRH3POLBSMN1; SMN2 | |
| SCHEMBL4368875 | 0.82 | AKR1C3 (0.70) | AKR1C3HRH4HRH3POLBSMN1; SMN2 | |
| SCHEMBL27306947 | 0.82 | AKR1C3 (0.66) | AKR1C3HRH4HRH3POLBSMN1; SMN2 | |
| SCHEMBL31487392 | 0.82 | AKR1C3 (0.70) | AKR1C3HRH4HRH3POLBSMN1; SMN2 | |
| SCHEMBL12964356 | 0.82 | AKR1C3 (0.68) | AKR1C3HRH4HRH3POLBSMN1; SMN2 | |
| SCHEMBL15962961 | 0.81 | AKR1C3 (0.80) | AKR1C3HRH4HRH3POLBSMN1; SMN2 | |
| SCHEMBL1810411 | 0.81 | DRD3 (0.64) | AKR1C3HRH4HRH3POLBSMN1; SMN2 |
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-2010487-A1 | 5-AMIDO-2-CARBOXAMIDE INDOLES | F. Hoffmann-Roche AG (CH) | 2009-01-07 | — | — | EP | disclosed |
| WO-2007115938-A1 | 5-AMIDO-2-CARBOXAMIDE INDOLES | F. HOFFMANN-LA ROCHE AG (CH) | 2007-10-18 | — | — | WO | disclosed |