Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR1 | P32246 | 1/20 | 0.50 |
| ▸ | CCR8 | P51685 | 1/20 | 0.50 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.45 |
| ▸ | TGFBR1 | P36897 | 7/20 | 0.42 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | METAP2 | P50579 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | NOS3 | P29474 | 1/20 | 0.38 |
| ▸ | NOS2 | P35228 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL13680667 | 0.84 | CCR1 (0.52) | CCR1CCR8CYP2A6TGFBR1MAPK14 | |
| SCHEMBL29949633 | 0.83 | TGFBR1 (0.50) | CCR1CCR8CYP2A6TGFBR1MAPK14 | |
| SCHEMBL12270020 | 0.83 | TGFBR1 (0.50) | CCR1CCR8CYP2A6TGFBR1MAPK14 | |
| SCHEMBL3422361 | 0.81 | CCR1 (0.75) | CCR1CCR8CYP2A6TGFBR1MAPK14 | |
| SCHEMBL13680670 | 0.80 | ALDH1A1 (0.47) | CCR1CCR8CYP2A6TGFBR1MAPK14 | |
| SCHEMBL13680672 | 0.79 | CYP1A2 (0.46) | CCR1CCR8CYP2A6TGFBR1ALDH1A1 | |
| SCHEMBL13680472 | 0.77 | CCR1 (0.52) | CCR1CCR8CYP2A6TGFBR1ALDH1A1 | |
| SCHEMBL2346786 | 0.77 | RARA (0.55) | CCR1CCR8CYP2A6ALDH1A1POLB | |
| Hydrochloric Acid SCHEMBL3088531 | 0.76 | RARA (0.54) | CCR1CCR8CYP2A6ALDH1A1POLB | |
| SCHEMBL16385228 | 0.76 | ALDH1A1 (0.72) | CCR1CCR8CYP2A6TGFBR1MAPK14 |
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 |
|---|---|---|---|---|---|---|---|
| US-7582658-B2 | Bicyclic compound | ASAHI KASEI PHARMA CORPORATION (JP) | 2009-09-01 | — | — | US | disclosed |
| US-7582658-B2 | Bicyclic compound | ASAHI KASEI PHARMA CORPORATION (JP) | 2009-09-01 | — | — | US | disclosed |