Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.48 |
| ▸ | TSHR | P16473 | 3/20 | 0.48 |
| ▸ | RAB9A | P51151 | 6/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.44 |
| ▸ | APOBEC3A | P31941 | 1/20 | 0.44 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | PABPC1 | P11940 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | THPO | P40225 | 1/20 | 0.41 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.41 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.41 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.41 |
| ▸ | ACHE | P22303 | 1/20 | 0.39 |
| ▸ | CDK4 | P11802 | 2/20 | 0.38 |
| ▸ | CCND1 | P24385 | 2/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL16131275 | 1.00 | ALDH1A1 (0.48) | ALDH1A1TSHRRAB9AKDM4EAPOBEC3A | |
| SCHEMBL23458039 | 0.85 | ALDH1A1 (0.56) | ALDH1A1TSHRRAB9AKDM4EAPOBEC3A | |
| SCHEMBL1976903 | 0.85 | ALDH1A1 (0.56) | ALDH1A1TSHRRAB9AKDM4EAPOBEC3A | |
| SCHEMBL23457968 | 0.85 | ALDH1A1 (0.56) | ALDH1A1TSHRRAB9AKDM4EAPOBEC3A | |
| SCHEMBL23457969 | 0.85 | ALDH1A1 (0.56) | ALDH1A1TSHRRAB9AKDM4EAPOBEC3A | |
| SCHEMBL23458040 | 0.85 | ALDH1A1 (0.56) | ALDH1A1TSHRRAB9AKDM4EAPOBEC3A | |
| SCHEMBL15132861 | 0.83 | TRPA1 (0.37) | ALDH1A1TSHRRAB9AKDM4EAPOBEC3A | |
| SCHEMBL1589395 | 0.80 | ALDH1A1 (0.62) | ALDH1A1TSHRRAB9AKDM4EAPOBEC3A | |
| SCHEMBL1035353 | 0.80 | ALDH1A1 (0.62) | ALDH1A1TSHRRAB9AKDM4EAPOBEC3A | |
| SCHEMBL1767678 | 0.78 | ALDH1A1 (0.59) | ALDH1A1TSHRRAB9AKDM4EAPOBEC3A |
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 |
|---|---|---|---|---|---|---|---|
| EP-0269236-B1 | PROCESS FOR SYNTHESIS OF A CHIRAL AZETIDINONE | MERCK & CO. INC. (US) | 1991-04-03 | — | — | EP | disclosed |