Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | BLM | P54132 | 1/20 | 0.40 |
| ▸ | GFER | P55789 | 1/20 | 0.40 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.40 |
| ▸ | CA2 | P00918 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | HTT | P42858 | 2/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | SLC13A5 | Q86YT5 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL7417637 | 0.73 | KMT2A (0.44) | ALDH1A1KDM4ELMNAKMT2AMEN1 | |
| SCHEMBL18785764 | 0.72 | ALDH1A1 (0.47) | ALDH1A1CYP3A4KDM4ELMNAGAA | |
| SCHEMBL16680275 | 0.70 | BLM (0.46) | ALDH1A1CYP3A4KDM4ELMNAGAA | |
| SCHEMBL28318468 | 0.70 | KDM4E (0.46) | ALDH1A1CYP3A4KDM4ELMNAGAA | |
| SCHEMBL5903600 | 0.69 | ALDH1A1 (0.43) | ALDH1A1CYP3A4KMT2AMEN1HTT | |
| SCHEMBL8773724 | 0.69 | ALDH1A1 (0.43) | ALDH1A1CYP3A4KMT2AMEN1HTT | |
| SCHEMBL8714007 | 0.69 | CA2 (0.38) | CA2KMT2AMEN1CYP1A2CYP2D6 | |
| SCHEMBL25476052 | 0.68 | ALDH1A1 (0.43) | ALDH1A1CYP3A4KDM4ELMNAGAA | |
| Sulfuric Acid SCHEMBL1607638 | 0.68 | ALDH1A1 (0.65) | ALDH1A1CYP3A4KDM4ELMNAGAA | |
| Trifluoromethanesulfonic Acid SCHEMBL3362549 | 0.67 | ALDH1A1 (0.50) | ALDH1A1CYP3A4KDM4ELMNAGAA |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5939587-A | DEBLOCKING, DESALTING, DESULFONATING AND OXIDATING TO ALDEHYDE; STORAGE STABILITY, MATERIALS HANDLING | G. D. SEARLE & COMPANY (US) | 1999-08-17 | — | — | US | claimed |
| US-5847201-A | N-protected/N-substituted-beta-amino hydroxy sulfonates | G.D. SEARLE & CO. (US) | 1998-12-08 | — | — | US | claimed |
| US-5939587-A | DEBLOCKING, DESALTING, DESULFONATING AND OXIDATING TO ALDEHYDE; STORAGE STABILITY, MATERIALS HANDLING | G. D. SEARLE & COMPANY (US) | 1999-08-17 | — | — | US | disclosed |
| US-5847201-A | N-protected/N-substituted-beta-amino hydroxy sulfonates | G.D. SEARLE & CO. (US) | 1998-12-08 | — | — | US | disclosed |