Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.60 |
| ▸ | UNG | P13051 | 1/20 | 0.48 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.48 |
| ▸ | SRC | P12931 | 1/20 | 0.42 |
| ▸ | TRIM24 | O15164 | 1/20 | 0.41 |
| ▸ | TRIM33 | Q9UPN9 | 1/20 | 0.41 |
| ▸ | MAOA | P21397 | 7/20 | 0.41 |
| ▸ | MAOB | P27338 | 7/20 | 0.41 |
| ▸ | CA12 | O43570 | 1/20 | 0.40 |
| ▸ | CA1 | P00915 | 1/20 | 0.40 |
| ▸ | CA2 | P00918 | 1/20 | 0.40 |
| ▸ | CA9 | Q16790 | 1/20 | 0.40 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.39 |
| ▸ | BRD4 | O60885 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 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 | |
|---|---|---|---|---|
| Isophthalic Dicarboxaldehyde SCHEMBL13992161 | 0.92 | ALDH1A1 (0.48) | ALDH1A1UNGCYP2A6SRCTRIM24 | |
| Isophthalic Dicarboxaldehyde SCHEMBL180566 | 0.87 | ALDH1A1 (0.67) | ALDH1A1UNGCYP2A6SRCTRIM24 | |
| Isophthalic Dicarboxaldehyde SCHEMBL4952540 | 0.87 | ALDH1A1 (0.67) | ALDH1A1UNGCYP2A6SRCTRIM24 | |
| Isophthalic Dicarboxaldehyde SCHEMBL28611144 | 0.84 | ALDH1A1 (0.67) | ALDH1A1UNGCYP2A6SRCTRIM24 | |
| Isophthalic Dicarboxaldehyde SCHEMBL20477528 | 0.81 | ALDH1A1 (0.61) | ALDH1A1UNGCYP2A6SRCTRIM24 | |
| Isophthalic Dicarboxaldehyde SCHEMBL4304012 | 0.81 | ALDH1A1 (0.63) | ALDH1A1UNGCYP2A6SRCTRIM24 | |
| Isophthalic Dicarboxaldehyde SCHEMBL16267528 | 0.79 | ALDH1A1 (0.58) | ALDH1A1UNGCYP2A6SRCTRIM24 | |
| Isophthalic Dicarboxaldehyde SCHEMBL8543662 | 0.78 | ALDH1A1 (0.46) | ALDH1A1UNGCYP2A6SRCTRIM24 | |
| SCHEMBL149900 | 0.75 | ALDH1A1 (0.54) | ALDH1A1UNGCYP2A6SRCTRIM24 | |
| SCHEMBL6521692 | 0.75 | ALDH1A1 (0.54) | ALDH1A1UNGCYP2A6SRCTRIM24 |
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-0552881-A1 | Anticancer benzaldehyde compounds | NORSK HYDRO A/S (NO) | 1993-07-28 | — | — | EP | disclosed |