Known targets — ChEMBL curated mechanism
ACHECHRM1CHRM3CHRNA1CHRNB1CHRNDCHRNECHRNG
The experimentally established mechanism targets of Ciaftalan. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TLR8 | Q9NR97 | 12/20 | 0.43 |
| ▸ | DNM1 | Q05193 | 4/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.35 |
| ▸ | TLR7 | Q9NYK1 | 1/20 | 0.35 |
| ▸ | ELANE | P08246 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| Ciaftalan SCHEMBL28514833 | 0.99 | TLR8 (0.44) | TLR8DNM1MEN1KMT2AALDH1A1 | |
| Ciaftalan SCHEMBL29211555 | 0.99 | TLR8 (0.44) | TLR8DNM1MEN1KMT2AALDH1A1 | |
| Ciaftalan SCHEMBL11520284 | 0.89 | MEN1 (0.39) | TLR8MEN1KMT2ATSHRELANE | |
| SCHEMBL29211538 | 0.87 | TLR8 (0.37) | TLR8MEN1KMT2ATSHRTLR7 | |
| Ciaftalan SCHEMBL9075585 | 0.83 | ELANE (0.36) | TLR8MEN1KMT2ATSHRELANE | |
| Ciaftalan SCHEMBL7950273 | 0.83 | HPGD (0.39) | TLR8MEN1KMT2AALDH1A1TSHR | |
| Ciaftalan SCHEMBL5973010 | 0.82 | PDE5A (0.40) | TLR8ALDH1A1TSHRELANE | |
| Ciaftalan SCHEMBL16209725 | 0.81 | SLC22A1 (0.35) | TLR8DNM1MEN1KMT2AALDH1A1 | |
| Ciaftalan SCHEMBL5564158 | 0.81 | MEN1 (0.39) | TLR8MEN1KMT2AELANE | |
| Ciaftalan SCHEMBL5559402 | 0.81 | MEN1 (0.39) | TLR8MEN1KMT2AELANE |
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-115650990-A | Fluorine-containing near-infrared absorption cationic phthalocyanine and preparation method thereof | 常州大学 | 2023-01-31 | — | — | CN | disclosed |