Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.43 |
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.41 |
| ▸ | RECQL | P46063 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | EGFR | P00533 | 2/20 | 0.39 |
| ▸ | RAB9A | P51151 | 3/20 | 0.38 |
| ▸ | NPC1 | O15118 | 2/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | HSP90AA1 | P07900 | 2/20 | 0.38 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | PKM | P14618 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | ATM | Q13315 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL9683262 | 1.00 | ALDH1A1 (0.43) | ALDH1A1MAPTKMT2ARECQLMAPK1 | |
| SCHEMBL28919959 | 1.00 | ALDH1A1 (0.43) | ALDH1A1MAPTKMT2ARECQLMAPK1 | |
| SCHEMBL712821 | 0.82 | MAPT (0.41) | ALDH1A1MAPTTDP1RAB9ANPC1 | |
| SCHEMBL22492769 | 0.82 | HTT (0.46) | ALDH1A1KMT2AHPGDHIF1AMEN1 | |
| SCHEMBL5242504 | 0.82 | HTT (0.46) | ALDH1A1KMT2AHPGDHIF1AMEN1 | |
| SCHEMBL27748314 | 0.80 | ALDH1A1 (0.49) | ALDH1A1MAPTKMT2ATDP1RAB9A | |
| SCHEMBL27770173 | 0.80 | LMNA (0.44) | ALDH1A1MAPTRECQLRAB9ANPC1 | |
| SCHEMBL7020743 | 0.80 | MAPT (0.44) | ALDH1A1MAPTTDP1HPGDKDM4E | |
| SCHEMBL28291551 | 0.79 | ALDH1A1 (0.43) | ALDH1A1MAPTKMT2ARECQLEGFR | |
| SCHEMBL27693488 | 0.79 | ALDH1A1 (0.43) | ALDH1A1MAPTKMT2ARECQLEGFR |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5169958-A | Reacting, 3-amino-2-propen-1-ones with magnesium halide in solvent | BASF AKTIENGESELLSCHAFT (DE) | 1992-12-08 | — | — | US | disclosed |
| EP-0480242-A2 | Method for the production of alpha,beta-unsaturated carbonyl compounds | BASF Aktiengesellschaft (DE) | 1992-04-15 | — | — | EP | disclosed |