Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACACB | O00763 | 1/20 | 0.44 |
| ▸ | HSD17B1 | P14061 | 3/20 | 0.42 |
| ▸ | CASP1 | P29466 | 1/20 | 0.41 |
| ▸ | CASP7 | P55210 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | MAOB | P27338 | 5/20 | 0.41 |
| ▸ | MAOA | P21397 | 3/20 | 0.41 |
| ▸ | BAZ2B | Q9UIF8 | 1/20 | 0.40 |
| ▸ | HRH3 | Q9Y5N1 | 3/20 | 0.39 |
| ▸ | BRD4 | O60885 | 1/20 | 0.39 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.39 |
| ▸ | KCNJ1 | P48048 | 1/20 | 0.39 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL7998745 | 0.89 | BRD4 (0.47) | ACACBMAOBMAOAHRH3BRD4 | |
| SCHEMBL8099995 | 0.78 | ALDH1A1 (0.54) | ACACBHSD17B1CASP1CASP7HSD17B10 | |
| SCHEMBL7984662 | 0.78 | RXRB (0.46) | HSD17B10 | |
| SCHEMBL4816674 | 0.77 | MAOB (0.44) | HSD17B1CASP1CASP7HSD17B10MAOB | |
| SCHEMBL4817434 | 0.77 | CASP1 (0.50) | ACACBHSD17B1CASP1CASP7HSD17B10 | |
| SCHEMBL6227273 | 0.76 | AKR1B1 (0.49) | ACACBHSD17B1CASP1CASP7HSD17B10 | |
| SCHEMBL7847761 | 0.74 | BRD4 (0.50) | ACACBHSD17B1CASP1CASP7HSD17B10 | |
| SCHEMBL3238273 | 0.74 | CASP1 (0.47) | ACACBHSD17B1CASP1CASP7HSD17B10 | |
| SCHEMBL86398 | 0.74 | CASP1 (0.47) | ACACBHSD17B1CASP1CASP7HSD17B10 | |
| SCHEMBL12379473 | 0.74 | TNKS2 (0.43) | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2001079209-A2 | DIAZAFLUORENONE IL-8 ANTAGONISTS | MILLENNIUM PHARMACEUTICALS, INC. (US) | 2001-10-25 | — | — | WO | disclosed |