Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.36 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.36 |
| ▸ | CASP3 | P42574 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.36 |
| ▸ | RELA | Q04206 | 1/20 | 0.36 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.36 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.36 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | ATG4B | Q9Y4P1 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 2/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | PTPN5 | P54829 | 1/20 | 0.31 |
| ▸ | NR1H3 | Q13133 | 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 | |
|---|---|---|---|---|
| SCHEMBL2045383 | 0.78 | CA2 (0.40) | ALDH1A1TSHRPTPN5TDP1 | |
| SCHEMBL28630479 | 0.76 | ALDH1A1 (0.40) | ALDH1A1NPC1PLA2G1BNFKB1CASP3 | |
| SCHEMBL4468064 | 0.75 | ALDH1A1 (0.39) | ALDH1A1NPC1PLA2G1BNFKB1CASP3 | |
| SCHEMBL2046204 | 0.74 | ALDH1A1 (0.53) | ALDH1A1NPC1PLA2G1BNFKB1CASP3 | |
| SCHEMBL28625579 | 0.72 | ALDH1A1 (0.35) | ALDH1A1NPC1PLA2G1BNFKB1CASP3 | |
| SCHEMBL28614786 | 0.71 | ALDH1A1 (0.39) | ALDH1A1NPC1PLA2G1BNFKB1CASP3 | |
| SCHEMBL2051686 | 0.71 | ALDH1A1 (0.53) | ALDH1A1NPC1PLA2G1BNFKB1CASP3 | |
| SCHEMBL28627162 | 0.70 | ALDH1A1 (0.31) | ALDH1A1TSHRTDP1 | |
| SCHEMBL11331789 | 0.70 | TSHR (0.44) | ALDH1A1TSHRCYP1A2CYP3A4CYP2C9 | |
| SCHEMBL21248550 | 0.69 | NPC1 (0.39) | ALDH1A1NPC1PLA2G1BNFKB1CASP3 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-113302213-A | Catalyst for olefin polymerization and process for producing olefin polymer containing polar group | 国立大学法人东京大学 | 2021-08-24 | — | — | CN | disclosed |
| EP-0716092-B1 | Organic transition metal compound and process for the preparation of polyolefin using same | TOSOH CORP (JP) | 2000-10-25 | — | — | EP | disclosed |
| US-5770666-A | METALLOCENE | TOSOH CORPORATION (JP) | 1998-06-23 | — | — | US | disclosed |
| EP-0716092-A1 | Organic transition metal compound and process for the preparation of polyolefin using same | TOSOH CORPORATION (JP) | 1996-06-12 | — | — | EP | disclosed |