Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 3/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 8/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 6/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 6/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 5/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.43 |
| ▸ | TSHR | P16473 | 4/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.43 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | CCR1 | P32246 | 2/20 | 0.41 |
| ▸ | CCR5 | P51681 | 2/20 | 0.41 |
| ▸ | CCR8 | P51685 | 2/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.40 |
| ▸ | CLK4 | Q9HAZ1 | 2/20 | 0.40 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | CYP2A6 | P11509 | 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 | |
|---|---|---|---|---|
| SCHEMBL13680767 | 0.76 | ACHE (0.37) | ACHECYP1A2CYP2D6CYP3A4ALDH1A1 | |
| SCHEMBL13139736 | 0.76 | IDO1 (0.44) | CYP1A2CYP2D6CYP2C19CYP3A4ALDH1A1 | |
| SCHEMBL16716059 | 0.75 | CYP1A2 (0.51) | CYP1A2CYP2D6CYP2C19CYP3A4ALDH1A1 | |
| SCHEMBL25543839 | 0.75 | CYP1A2 (0.47) | CYP1A2CYP2D6CYP2C19CYP3A4ALDH1A1 | |
| SCHEMBL24828809 | 0.74 | CYP17A1 (0.45) | ALDH1A1TDP1LMNAMAPTNPSR1 | |
| SCHEMBL18730150 | 0.73 | ALPL (0.42) | ALDH1A1MAPK1TDP1CCR1CCR5 | |
| SCHEMBL987521 | 0.73 | CCR1 (0.61) | CYP1A2CYP2D6CYP2C19CYP3A4ALDH1A1 | |
| SCHEMBL16526758 | 0.72 | HSD17B1 (0.45) | CYP1A2CYP2D6CYP2C19CYP3A4ALDH1A1 | |
| SCHEMBL13299575 | 0.72 | IDO1 (0.51) | ACHECYP2A6IDO1METAP2KDM1A | |
| SCHEMBL3826324 | 0.71 | L3MBTL1 (0.50) | CYP1A2CYP2D6CYP2C19CYP3A4ALDH1A1 |
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 |