Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TYR | P14679 | 1/20 | 0.42 |
| ▸ | VKORC1 | Q9BQB6 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | BRD4 | O60885 | 9/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.34 |
| ▸ | MCOLN3 | Q8TDD5 | 1/20 | 0.34 |
| ▸ | DAO | P14920 | 1/20 | 0.33 |
| ▸ | ESR1 | P03372 | 1/20 | 0.33 |
| ▸ | PDCD1 | Q15116 | 1/20 | 0.33 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.33 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.33 |
| ▸ | IGLV6-57 | P01721 | 1/20 | 0.32 |
| ▸ | BRD2 | P25440 | 1/20 | 0.32 |
| ▸ | BRD3 | Q15059 | 1/20 | 0.32 |
| ▸ | BRDT | Q58F21 | 1/20 | 0.32 |
| ▸ | TACR1 | P25103 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL21787943 | 0.72 | BRD4 (0.45) | ALDH1A1BRD4GAATSHRHTT | |
| SCHEMBL21787730 | 0.70 | BRD4 (0.65) | ALDH1A1BRD4BRD2BRD3BRDT | |
| SCHEMBL21787944 | 0.68 | TYR (0.42) | TYRVKORC1ALDH1A1BRD4GAA | |
| SCHEMBL9064122 | 0.66 | TYR (0.52) | TYRALDH1A1GAATSHRHTT | |
| SCHEMBL7499823 | 0.66 | TAAR1 (0.50) | TYRALDH1A1TSHRESR1PDCD1 | |
| Benzene SCHEMBL28192760 | 0.66 | TAAR1 (0.50) | TYRALDH1A1TSHRESR1PDCD1 | |
| SCHEMBL169730 | 0.66 | TAAR1 (0.50) | TYRALDH1A1TSHRESR1PDCD1 | |
| SCHEMBL22749374 | 0.66 | TYR (0.47) | TYRVKORC1ALDH1A1GAATSHR | |
| SCHEMBL12323453 | 0.66 | TYR (0.71) | TYRVKORC1GAATSHRHTT | |
| Phenol SCHEMBL28206460 | 0.65 | ESR1 (0.67) | TYRALDH1A1TSHRESR1PDCD1 |
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-2020043821-A1 | FURAN DERIVATIVES AS BROMODOMAIN INHIBITORS | GLAXOSMITHKLINE INTELLECTUAL PROPERTY (NO.2) LIMITED (GB) | 2020-03-05 | — | — | WO | disclosed |