Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 1/20 | 0.44 |
| ▸ | TGFBR1 | P36897 | 9/20 | 0.41 |
| ▸ | CCR1 | P32246 | 1/20 | 0.41 |
| ▸ | CCR8 | P51685 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | PKM | P14618 | 1/20 | 0.40 |
| ▸ | PIM1 | P11309 | 1/20 | 0.39 |
| ▸ | IRAK4 | Q9NWZ3 | 1/20 | 0.38 |
| ▸ | JAK2 | O60674 | 1/20 | 0.38 |
| ▸ | JAK1 | P23458 | 1/20 | 0.38 |
| ▸ | TYK2 | P29597 | 1/20 | 0.38 |
| ▸ | JAK3 | P52333 | 1/20 | 0.38 |
| ▸ | RORC | P51449 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | BTK | Q06187 | 1/20 | 0.37 |
| ▸ | CCNC | P24863 | 1/20 | 0.37 |
| ▸ | FLT3 | P36888 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL16785592 | 0.78 | TGFBR1 (0.45) | CYP2A6TGFBR1CCR1CCR8MAPT | |
| SCHEMBL14819954 | 0.77 | JAK2 (0.44) | CYP2A6TGFBR1CCR1CCR8PIM1 | |
| SCHEMBL13680646 | 0.76 | EIF2AK2 (0.46) | — | |
| SCHEMBL27091383 | 0.75 | MAPK1 (0.42) | CYP2A6TGFBR1MAPTKDM4EALDH1A1 | |
| SCHEMBL20599739 | 0.75 | NAMPT (0.44) | CYP2A6TGFBR1CCR1CCR8IRAK4 | |
| SCHEMBL29077594 | 0.74 | TGFBR1 (0.39) | CYP2A6TGFBR1IRAK4RORCHTT | |
| SCHEMBL27090747 | 0.73 | TGFBR1 (0.44) | CYP2A6TGFBR1CCR1CCR8IRAK4 | |
| SCHEMBL12269967 | 0.72 | CCR1 (0.52) | CYP2A6TGFBR1CCR1CCR8MAPT | |
| SCHEMBL30625193 | 0.72 | CCR1 (0.52) | CYP2A6TGFBR1CCR1CCR8MAPT | |
| SCHEMBL3806972 | 0.72 | PDK2 (0.45) | MAPTKDM4EALDH1A1LMNAPKM |
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 |