Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DNMT3B | Q9UBC3 | 4/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.42 |
| ▸ | MEN1 | O00255 | 3/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.42 |
| ▸ | NPC1 | O15118 | 2/20 | 0.42 |
| ▸ | RAB9A | P51151 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.42 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.42 |
| ▸ | RELA | Q04206 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 3/20 | 0.42 |
| ▸ | MAOB | P27338 | 2/20 | 0.42 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL11111678 | 0.85 | ALDH1A1 (0.48) | ALDH1A1CYP2C19MEN1KMT2ANPC1 | |
| SCHEMBL11109487 | 0.80 | ALDH1A1 (0.47) | DNMT3BALDH1A1MEN1KMT2ANPC1 | |
| SCHEMBL26120387 | 0.80 | ATM (0.50) | ALDH1A1CYP2C19MEN1KMT2ANPC1 | |
| SCHEMBL11108787 | 0.79 | ALDH1A1 (0.44) | DNMT3BALDH1A1MEN1KMT2ANPC1 | |
| SCHEMBL11109901 | 0.78 | HTR2A (0.43) | DNMT3BALDH1A1NPC1RAB9AKDM4E | |
| SCHEMBL11109228 | 0.78 | DNMT3B (0.40) | DNMT3BALDH1A1CYP2C19NPC1RAB9A | |
| SCHEMBL11113834 | 0.77 | ATM (0.62) | DNMT3BALDH1A1MEN1KMT2AKDM4E | |
| SCHEMBL11108444 | 0.77 | MTNR1A (0.41) | DNMT3BALDH1A1MEN1KMT2ANPC1 | |
| SCHEMBL21781053 | 0.76 | KDM4E (0.39) | ALDH1A1CYP2C19MEN1KMT2ARAB9A | |
| SCHEMBL11105536 | 0.76 | ALDH1A1 (0.39) | ALDH1A1KDM4ESMN1; SMN2MAPTMAOB |
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 |
|---|---|---|---|---|---|---|---|
| US-4463001-A | ANTIULCER AGENTS | FARMITALIA CARLO ERBA S.P.A. (IT) | 1984-07-31 | — | — | US | disclosed |