Known targets — ChEMBL curated mechanism
CHRM1CHRM2CHRM3CHRM4CHRM5SLC6A2dacAdacBdacCftsImrcAmrcBmrdA
The experimentally established mechanism targets of None. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.36 |
| ▸ | PKM | P14618 | 2/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 2/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.34 |
| ▸ | MMP2 | P08253 | 2/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.33 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.33 |
| ▸ | CA1 | P00915 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
| ▸ | MMP1 | P03956 | 1/20 | 0.33 |
| ▸ | MMP9 | P14780 | 1/20 | 0.33 |
| ▸ | MMP8 | P22894 | 1/20 | 0.33 |
| ▸ | MMP13 | P45452 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL6726409 | 0.88 | LMNA (0.36) | ALDH1A1CYP2C19GAAKMT2AHSD17B10 | |
| SCHEMBL6731545 | 0.88 | ALDH1A1 (0.37) | ALDH1A1CYP2C19GAAKMT2AHSD17B10 | |
| SCHEMBL6550482 | 0.87 | ALDH1A1 (0.39) | ALDH1A1PKMCYP2C19HTTGAA | |
| SCHEMBL6728423 | 0.87 | ALDH1A1 (0.39) | ALDH1A1CYP2C19HTTGAAKMT2A | |
| SCHEMBL6726398 | 0.85 | LMNA (0.35) | ALDH1A1CYP2C19HTTKMT2ANPC1 | |
| SCHEMBL6550447 | 0.85 | ALDH1A1 (0.41) | ALDH1A1PKMHTTGAAKMT2A | |
| SCHEMBL6723151 | 0.83 | ALDH1A1 (0.39) | ALDH1A1KMT2ANPC1RAB9ACYP3A4 | |
| SCHEMBL6731614 | 0.83 | MAPT (0.37) | ALDH1A1CYP2C19HTTKMT2ARAB9A | |
| SCHEMBL6734161 | 0.83 | LMNA (0.38) | ALDH1A1PKMCYP2C19HTTGAA | |
| SCHEMBL6733943 | 0.83 | L3MBTL1 (0.41) | ALDH1A1PKMCYP2C19GAAKMT2A |
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 |
|---|---|---|---|---|---|---|---|
| US-20040224251-A1 | Positive resist composition | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2004-11-11 | — | — | US | disclosed |
| US-6548220-B2 | Containing acid generator | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2003-04-15 | — | — | US | disclosed |