Known targets — ChEMBL curated mechanism
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 | 0.35 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.35 |
| ▸ | HPGD | P15428 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 2/20 | 0.33 |
| ▸ | LMNA | P02545 | 3/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.32 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.31 |
| ▸ | MGAM | O43451 | 1/20 | 0.31 |
| ▸ | SI | P14410 | 1/20 | 0.31 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.31 |
| ▸ | SOAT1 | P35610 | 1/20 | 0.31 |
| ▸ | POLB | P06746 | 2/20 | 0.31 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.31 |
| ▸ | CA12 | O43570 | 1/20 | 0.31 |
| ▸ | CA1 | P00915 | 1/20 | 0.31 |
| ▸ | CA2 | P00918 | 1/20 | 0.31 |
| ▸ | CA9 | Q16790 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 2/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL3228295 | 0.86 | ALDH1A1 (0.43) | ALDH1A1KMT2AHPGDMEN1GAA | |
| SCHEMBL4848140 | 0.78 | CA2 (0.30) | CA2TSHR | |
| SCHEMBL1534181 | 0.76 | — | — | |
| SCHEMBL27949080 | 0.75 | GAA (0.35) | ALDH1A1KMT2AHPGDMEN1GAA | |
| SCHEMBL27949079 | 0.75 | CHRNB2 (0.45) | ALDH1A1KMT2AMEN1GAALMNA | |
| SCHEMBL6214367 | 0.74 | — | — | |
| SCHEMBL872502 | 0.73 | — | — | |
| SCHEMBL6053661 | 0.73 | — | — | |
| SCHEMBL14559286 | 0.73 | ALDH1A1 (0.36) | ALDH1A1KMT2AHPGDMEN1GAA | |
| SCHEMBL6203840 | 0.72 | ALDH1A1 (0.39) | ALDH1A1KMT2AHPGDLMNATSHR |
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-104947430-A | Environment-friendly garment material finishing auxiliary | SHI ZHONG | 2015-09-30 | — | — | CN | disclosed |