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 | 6/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 4/20 | 0.37 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.34 |
| ▸ | CA1 | P00915 | 2/20 | 0.34 |
| ▸ | CA2 | P00918 | 2/20 | 0.34 |
| ▸ | MMP1 | P03956 | 1/20 | 0.34 |
| ▸ | MMP2 | P08253 | 1/20 | 0.34 |
| ▸ | MMP9 | P14780 | 1/20 | 0.34 |
| ▸ | MMP8 | P22894 | 1/20 | 0.34 |
| ▸ | MMP13 | P45452 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | RECQL | P46063 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 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 | |
|---|---|---|---|---|
| SCHEMBL6551283 | 0.88 | ALDH1A1 (0.42) | ALDH1A1KMT2AMEN1LMNAHSD11B1 | |
| SCHEMBL6551313 | 0.87 | ALDH1A1 (0.41) | ALDH1A1KMT2AMEN1LMNAGAA | |
| SCHEMBL6551090 | 0.84 | ALDH1A1 (0.40) | ALDH1A1KMT2AMEN1LMNAGAA | |
| SCHEMBL6550458 | 0.83 | ALDH1A1 (0.42) | ALDH1A1KMT2AMEN1LMNAGAA | |
| SCHEMBL6551397 | 0.82 | ALDH1A1 (0.41) | ALDH1A1KMT2AMEN1LMNAHSD11B1 | |
| SCHEMBL6551415 | 0.82 | ALDH1A1 (0.39) | ALDH1A1KMT2AMEN1LMNACYP3A4 | |
| SCHEMBL6549916 | 0.81 | ALDH1A1 (0.43) | ALDH1A1KMT2AMEN1LMNAHSD11B1 | |
| SCHEMBL6550442 | 0.80 | KMT2A (0.39) | ALDH1A1KMT2AMEN1LMNACYP3A4 | |
| SCHEMBL6549439 | 0.79 | ALDH1A1 (0.39) | ALDH1A1KMT2AMEN1LMNACA1 | |
| SCHEMBL6727866 | 0.79 | KMT2A (0.40) | ALDH1A1KMT2AMEN1LMNACYP3A4 |
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 |