Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.60 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.59 |
| ▸ | HSD17B1 | P14061 | 4/20 | 0.56 |
| ▸ | HSD17B2 | P37059 | 3/20 | 0.56 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.54 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.54 |
| ▸ | MEN1 | O00255 | 1/20 | 0.54 |
| ▸ | ESR1 | P03372 | 1/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.54 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.53 |
| ▸ | MMP3 | P08254 | 1/20 | 0.52 |
| ▸ | BCL2L1 | Q07817 | 1/20 | 0.52 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.52 |
| ▸ | NPC1 | O15118 | 1/20 | 0.48 |
| ▸ | TP53 | P04637 | 1/20 | 0.48 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.48 |
| ▸ | RAB9A | P51151 | 1/20 | 0.48 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.48 |
| ▸ | RELA | Q04206 | 1/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL5379998 | 0.89 | ESR1 (0.70) | TSHRALOX5HSD17B1HSD17B2CYP3A4 | |
| SCHEMBL29434858 | 0.89 | ESR1 (0.70) | TSHRALOX5HSD17B1HSD17B2CYP3A4 | |
| SCHEMBL29788033 | 0.89 | TAAR1 (0.61) | TSHRALOX5ESR2TAAR1NPC1 | |
| SCHEMBL170231 | 0.89 | TAAR1 (0.61) | TSHRALOX5ESR2TAAR1NPC1 | |
| SCHEMBL1029061 | 0.86 | TSHR (0.73) | TSHRALOX5HSD17B1HSD17B2CYP3A4 | |
| SCHEMBL16394095 | 0.86 | TAAR1 (0.65) | TSHRALOX5ESR2TAAR1NPC1 | |
| SCHEMBL5539603 | 0.86 | TAAR1 (0.59) | TSHRALOX5ESR2TAAR1NPC1 | |
| SCHEMBL19501160 | 0.86 | TAAR1 (0.59) | TSHRALOX5ESR2TAAR1NPC1 | |
| SCHEMBL31139395 | 0.86 | TAAR1 (0.59) | TSHRALOX5ESR2TAAR1NPC1 | |
| Hydrogen Sulfide SCHEMBL9316307 | 0.86 | TAAR1 (0.59) | TSHRALOX5ESR2TAAR1NPC1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-106220994-A | A kind of high intensity PP RCT anti-flaming tubular product and preparation method | 刘志光 | 2016-12-14 | — | — | CN | disclosed |