Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DYRK1A | Q13627 | 1/20 | 0.56 |
| ▸ | CCR1 | P32246 | 1/20 | 0.47 |
| ▸ | CCR8 | P51685 | 1/20 | 0.47 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.39 |
| ▸ | METAP2 | P50579 | 1/20 | 0.39 |
| ▸ | KDR | P35968 | 1/20 | 0.38 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.38 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.38 |
| ▸ | NOS3 | P29474 | 1/20 | 0.36 |
| ▸ | NOS2 | P35228 | 1/20 | 0.36 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.36 |
| ▸ | TGFBR1 | P36897 | 4/20 | 0.35 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.35 |
| ▸ | ERN1 | O75460 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | GHSR | Q92847 | 2/20 | 0.34 |
| ▸ | GRM5 | P41594 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL15859041 | 0.80 | CCR1 (0.54) | CCR1CCR8CYP2A6METAP2KDR | |
| SCHEMBL13680693 | 0.77 | CCR1 (0.50) | CCR1CCR8CYP2A6METAP2KDR | |
| SCHEMBL13680697 | 0.74 | KDR (0.51) | CCR1CCR8CYP2A6METAP2KDR | |
| SCHEMBL13680698 | 0.74 | CCR1 (0.47) | DYRK1ACCR1CCR8CYP2A6METAP2 | |
| SCHEMBL5158289 | 0.74 | KDR (0.50) | DYRK1AKDRSLC6A3ERN1NPC1 | |
| SCHEMBL13681316 | 0.73 | LOXL2 (0.50) | CCR1CCR8CYP2A6METAP2KDR | |
| SCHEMBL14606354 | 0.71 | CCR1 (0.62) | CCR1CCR8CYP2A6METAP2KDR | |
| SCHEMBL13680662 | 0.71 | HSD17B1 (0.51) | DYRK1AKDRERN1MEN1KMT2A | |
| SCHEMBL13680758 | 0.69 | DYRK1A (0.43) | DYRK1ACYP2A6HCRTR1HCRTR2ERN1 | |
| SCHEMBL20233429 | 0.69 | CYP2A6 (0.63) | CYP2A6NPC1RAB9A |
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 |