Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 5/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.53 |
| ▸ | MEN1 | O00255 | 3/20 | 0.53 |
| ▸ | LMNA | P02545 | 2/20 | 0.53 |
| ▸ | USP2 | O75604 | 2/20 | 0.53 |
| ▸ | MAPT | P10636 | 1/20 | 0.53 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.53 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.53 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.53 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.53 |
| ▸ | HPGD | P15428 | 1/20 | 0.53 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.53 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.53 |
| ▸ | L3MBTL1 | Q9Y468 | 6/20 | 0.53 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.53 |
| ▸ | RAB9A | P51151 | 3/20 | 0.50 |
| ▸ | POLB | P06746 | 1/20 | 0.50 |
| ▸ | RECQL | P46063 | 1/20 | 0.50 |
| ▸ | NPC1 | O15118 | 2/20 | 0.47 |
| ▸ | CASP3 | P42574 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL15979682 | 0.84 | KMT2A (0.50) | KMT2AALDH1A1MEN1MAPTCYP1A2 | |
| SCHEMBL16398924 | 0.74 | LMNA (0.78) | KMT2AALDH1A1MEN1LMNAUSP2 | |
| SCHEMBL28068594 | 0.74 | ALDH1A1 (0.67) | KMT2AALDH1A1LMNAUSP2MAPT | |
| SCHEMBL27907452 | 0.73 | L3MBTL1 (0.66) | KMT2AALDH1A1MEN1LMNAUSP2 | |
| SCHEMBL4791866 | 0.72 | L3MBTL1 (0.63) | KMT2AALDH1A1MEN1LMNAUSP2 | |
| SCHEMBL15988918 | 0.72 | SMN1; SMN2 (0.58) | KMT2AMEN1LMNAUSP2CYP1A2 | |
| Ethyl Nicotinate SCHEMBL8164637 | 0.72 | L3MBTL1 (0.71) | KMT2AALDH1A1MEN1LMNAUSP2 | |
| Ethyl Nicotinate SCHEMBL24853 | 0.72 | L3MBTL1 (0.71) | KMT2AALDH1A1MEN1LMNAUSP2 | |
| Ethyl Nicotinate SCHEMBL29958752 | 0.72 | L3MBTL1 (0.71) | KMT2AALDH1A1MEN1LMNAUSP2 | |
| Ethyl Nicotinate SCHEMBL1330922 | 0.72 | L3MBTL1 (0.71) | KMT2AALDH1A1MEN1LMNAUSP2 |
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-115433163-A | NLRP3 inflammasome inhibitor and application thereof | 药捷安康(南京)科技股份有限公司 | 2022-12-06 | — | — | CN | disclosed |