Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR1 | P32246 | 1/20 | 0.52 |
| ▸ | CCR8 | P51685 | 1/20 | 0.52 |
| ▸ | MAPT | P10636 | 2/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.50 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.50 |
| ▸ | ADORA3 | P0DMS8 | 3/20 | 0.46 |
| ▸ | HSD17B1 | P14061 | 1/20 | 0.46 |
| ▸ | GRM5 | P41594 | 1/20 | 0.45 |
| ▸ | MAOB | P27338 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 2/20 | 0.42 |
| ▸ | BRD4 | O60885 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | RARA | P10276 | 1/20 | 0.41 |
| ▸ | RARB | P10826 | 1/20 | 0.41 |
| ▸ | TGFBR1 | P36897 | 1/20 | 0.41 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL2346786 | 0.86 | RARA (0.55) | CCR1CCR8SMN1; SMN2CYP2A6GRM5 | |
| SCHEMBL13680552 | 0.84 | CYP2A6 (0.53) | CCR1CCR8CYP2A6GRM5BRD4 | |
| SCHEMBL29949633 | 0.84 | TGFBR1 (0.50) | CCR1CCR8CYP2A6GRM5TGFBR1 | |
| Hydrochloric Acid SCHEMBL3088531 | 0.84 | RARA (0.54) | CCR1CCR8SMN1; SMN2CYP2A6GRM5 | |
| SCHEMBL12270020 | 0.84 | TGFBR1 (0.50) | CCR1CCR8CYP2A6GRM5TGFBR1 | |
| SCHEMBL3422361 | 0.82 | CCR1 (0.75) | CCR1CCR8MAPTCYP2A6RAB9A | |
| SCHEMBL13680667 | 0.82 | CCR1 (0.52) | CCR1CCR8MAPTCYP2A6GRM5 | |
| SCHEMBL13680501 | 0.81 | GRM5 (0.52) | CCR1CCR8MAPTSMN1; SMN2CYP2A6 | |
| SCHEMBL13680471 | 0.81 | TDP1 (0.50) | CCR1CCR8MAPTSMN1; SMN2CYP2A6 | |
| SCHEMBL13680473 | 0.81 | TGFBR1 (0.48) | CCR1CCR8SMN1; SMN2CYP2A6GRM5 |
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 |