Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 4/20 | 0.56 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.56 |
| ▸ | GAA | P10253 | 1/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 2/20 | 0.41 |
| ▸ | HTT | P42858 | 2/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | TLR2 | O60603 | 2/20 | 0.37 |
| ▸ | TLR4 | O00206 | 1/20 | 0.37 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.36 |
| ▸ | PTGES2 | Q9H7Z7 | 1/20 | 0.36 |
| ▸ | SRC | P12931 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | THRB | P10828 | 1/20 | 0.35 |
| ▸ | BLM | P54132 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL16470387 | 0.84 | SRC (0.41) | LMNAKMT2AGAAALDH1A1CYP1A2 | |
| SCHEMBL27645264 | 0.82 | ALDH1A1 (0.39) | LMNAKMT2AGAAALDH1A1CYP1A2 | |
| SCHEMBL18112650 | 0.80 | CA1 (0.53) | LMNAALDH1A1CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL96815 | 0.78 | ALDH1A1 (0.55) | LMNAKMT2AGAAALDH1A1CYP1A2 | |
| SCHEMBL31241188 | 0.78 | LMNA (0.50) | LMNAKMT2AGAAALDH1A1CYP1A2 | |
| SCHEMBL28195278 | 0.78 | LMNA (0.50) | LMNAKMT2AGAAALDH1A1CYP1A2 | |
| SCHEMBL6955863 | 0.76 | LMNA (0.60) | LMNAKMT2AGAAALDH1A1CYP1A2 | |
| SCHEMBL9590947 | 0.76 | CTNNB1 (0.45) | GAAALDH1A1HTTTDP1L3MBTL1 | |
| SCHEMBL5919466 | 0.76 | SLC22A12 (0.42) | PTGDR2PTGES2CA1CA2 | |
| SCHEMBL1252353 | 0.76 | ALDH1A1 (0.42) | LMNAGAAALDH1A1HPGDHTT |
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-106255679-B | As NAThe heterocyclic compound and application thereof of V channel inhibitor | 默克专利有限公司 | 2019-09-06 | — | — | CN | disclosed |
| CN-106255679-A | As Naheterocyclic compound of V channel inhibitor and application thereof | 默克专利有限公司 | 2016-12-21 | — | — | CN | disclosed |