Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRB2 | P07550 | 1/20 | 0.37 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.37 |
| ▸ | DPP4 | P27487 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.34 |
| ▸ | HPGD | P15428 | 2/20 | 0.34 |
| ▸ | BCL2L1 | Q07817 | 1/20 | 0.34 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 2/20 | 0.33 |
| ▸ | HTR7 | P34969 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | PDCD1 | Q15116 | 1/20 | 0.32 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.32 |
| ▸ | BACE1 | P56817 | 1/20 | 0.31 |
| ▸ | MMP9 | P14780 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 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 | |
|---|---|---|---|---|
| SCHEMBL1732809 | 0.72 | ALDH1A1 (0.40) | ALDH1A1 | |
| SCHEMBL463323 | 0.70 | ALDH1A1 (0.36) | ALDH1A1HTT | |
| Biphenyl SCHEMBL28773768 | 0.70 | ALDH1A1 (0.45) | ALDH1A1HSD17B10HPGDBCL2L1MAPK1 | |
| SCHEMBL16756188 | 0.69 | ALDH1A1 (0.46) | DPP4ALDH1A1HSD17B10HPGDBCL2L1 | |
| SCHEMBL28676010 | 0.69 | ALDH1A1 (0.46) | DPP4ALDH1A1HSD17B10HPGDBCL2L1 | |
| SCHEMBL29351292 | 0.69 | ALDH1A1 (0.46) | DPP4ALDH1A1HSD17B10HPGDBCL2L1 | |
| SCHEMBL4079881 | 0.69 | ALDH1A1 (0.39) | ALDH1A1 | |
| Biphenyl SCHEMBL28806829 | 0.67 | ALDH1A1 (0.41) | ALDH1A1HPGDBCL2L1HTTGAA | |
| SCHEMBL7105248 | 0.67 | DPP4 (0.50) | ADRB2ADRB1DPP4HTR7KMT2A | |
| Butadiene SCHEMBL9807163 | 0.67 | ALDH1A1 (0.48) | ADRB2ADRB1DPP4ALDH1A1HSD17B10 |
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-1995016671-A1 | TRIFLATE-MEDIATED PREPARATION AND USE OF IODONIUM COMPOUNDS | THE CHILDREN'S MEDICAL CENTER CORPORATION (US) | 1995-06-22 | — | — | WO | disclosed |