Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR5A1 | Q13285 | 1/20 | 0.58 |
| ▸ | TYR | P14679 | 2/20 | 0.54 |
| ▸ | HTT | P42858 | 2/20 | 0.54 |
| ▸ | MEN1 | O00255 | 1/20 | 0.54 |
| ▸ | TP53 | P04637 | 1/20 | 0.54 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.54 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.54 |
| ▸ | MAPT | P10636 | 1/20 | 0.54 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.54 |
| ▸ | TSHR | P16473 | 1/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.54 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.54 |
| ▸ | ESR1 | P03372 | 2/20 | 0.51 |
| ▸ | CYSLTR2 | Q9NS75 | 1/20 | 0.51 |
| ▸ | CYSLTR1 | Q9Y271 | 1/20 | 0.51 |
| ▸ | LTA4H | P09960 | 1/20 | 0.50 |
| ▸ | S1PR2 | O95136 | 1/20 | 0.50 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.50 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.50 |
| ▸ | LPAR2 | Q9HBW0 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL19433097 | 0.98 | NR5A1 (0.55) | NR5A1TYRHTTMEN1TP53 | |
| SCHEMBL19433121 | 0.93 | LTA4H (0.52) | NR5A1TYRHTTMEN1TP53 | |
| SCHEMBL4963128 | 0.88 | NR5A1 (0.66) | NR5A1MEN1TP53MAPTTSHR | |
| SCHEMBL4960102 | 0.88 | NR5A1 (0.66) | NR5A1MEN1TP53MAPTTSHR | |
| SCHEMBL4961743 | 0.88 | NR5A1 (0.66) | NR5A1MEN1TP53MAPTTSHR | |
| SCHEMBL4963096 | 0.88 | NR5A1 (0.66) | NR5A1MEN1TP53MAPTTSHR | |
| SCHEMBL4957844 | 0.88 | NR5A1 (0.66) | NR5A1MEN1TP53MAPTTSHR | |
| SCHEMBL19433111 | 0.87 | LTA4H (0.48) | TYRHTTMEN1TP53CYP3A4 | |
| SCHEMBL11329254 | 0.86 | SMPD1 (0.60) | NR5A1TYRHTTMEN1TP53 | |
| SCHEMBL14557522 | 0.86 | SMPD1 (0.60) | NR5A1TYRHTTMEN1TP53 |
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 |
|---|---|---|---|---|---|---|---|
| CN-106029045-B | Dental composition and use thereof | 3M创新有限公司 | 2020-04-03 | — | — | CN | disclosed |
| CN-106029045-A | Dental composition and use thereof | 3M创新有限公司 | 2016-10-12 | — | — | CN | disclosed |