Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B1 | P14061 | 2/20 | 0.62 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.47 |
| ▸ | RARB | P10826 | 4/20 | 0.43 |
| ▸ | RARA | P10276 | 1/20 | 0.43 |
| ▸ | RARG | P13631 | 1/20 | 0.43 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 2/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | BCL2 | P10415 | 1/20 | 0.39 |
| ▸ | RXRA | P19793 | 1/20 | 0.38 |
| ▸ | RXRB | P28702 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | PRKCI | P41743 | 1/20 | 0.37 |
| ▸ | PPARG | P37231 | 1/20 | 0.37 |
| ▸ | PPARA | Q07869 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | XBP1 | P17861 | 1/20 | 0.37 |
| ▸ | HIF1A | Q16665 | 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 | |
|---|---|---|---|---|
| SCHEMBL27510448 | 0.86 | HSD17B1 (0.59) | HSD17B1MCL1RARBRARARARG | |
| SCHEMBL4096811 | 0.77 | HSD17B1 (1.00) | HSD17B1ALOX5ALDH1A1DCLRE1ADCLRE1B | |
| SCHEMBL3737547 | 0.76 | HSD17B1 (0.58) | HSD17B1RAB9AALDH1A1LMNAMAPT | |
| SCHEMBL29827550 | 0.76 | HSD17B1 (0.58) | HSD17B1RAB9AALDH1A1LMNAMAPT | |
| SCHEMBL7324041 | 0.75 | HSD17B1 (0.45) | HSD17B1RAB9ASMN1; SMN2RXRANPC1 | |
| SCHEMBL3084044 | 0.75 | HSD17B1 (0.57) | HSD17B1ALOX5RAB9ASMN1; SMN2NPC1 | |
| SCHEMBL7019419 | 0.74 | DCLRE1B (0.66) | HSD17B1MCL1RARBRARARARG | |
| SCHEMBL15197077 | 0.73 | PTGDR2 (0.44) | HSD17B1RAB9APRKCIMAPT | |
| SCHEMBL15344634 | 0.73 | PPARA (0.47) | MCL1RARBRARARARGRAB9A | |
| SCHEMBL4095554 | 0.73 | HSD17B1 (0.69) | HSD17B1RAB9ASMN1; SMN2NPC1ALDH1A1 |
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-2017098440-A1 | SUBSTITUTED BENZAZINONES AS ANTIBACTERIAL COMPOUNDS | GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) | 2017-06-15 | — | — | WO | disclosed |