Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.54 |
| ▸ | POLB | P06746 | 4/20 | 0.52 |
| ▸ | TSHR | P16473 | 1/20 | 0.50 |
| ▸ | CASP1 | P29466 | 1/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.50 |
| ▸ | MAPT | P10636 | 4/20 | 0.49 |
| ▸ | RAB9A | P51151 | 1/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.49 |
| ▸ | ATM | Q13315 | 1/20 | 0.48 |
| ▸ | FLT1 | P17948 | 2/20 | 0.47 |
| ▸ | FLT4 | P35916 | 2/20 | 0.47 |
| ▸ | KDR | P35968 | 2/20 | 0.47 |
| ▸ | THRB | P10828 | 1/20 | 0.46 |
| ▸ | RECQL | P46063 | 1/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.46 |
| ▸ | ABL1 | P00519 | 1/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.46 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL9723904 | 1.00 | ALDH1A1 (0.54) | ALDH1A1POLBTSHRCASP1SMN1; SMN2 | |
| SCHEMBL10479059 | 0.89 | ALDH1A1 (0.53) | ALDH1A1POLBTSHRCASP1SMN1; SMN2 | |
| SCHEMBL9610119 | 0.85 | CYP1A2 (0.49) | ALDH1A1SMN1; SMN2MAPTRAB9AMAPK1 | |
| SCHEMBL1337295 | 0.84 | POLB (0.53) | ALDH1A1POLBTSHRCASP1SMN1; SMN2 | |
| SCHEMBL1337293 | 0.84 | POLB (0.53) | ALDH1A1POLBTSHRCASP1SMN1; SMN2 | |
| SCHEMBL8602411 | 0.83 | ERN1 (0.45) | ALDH1A1POLBSMN1; SMN2MAPTRAB9A | |
| SCHEMBL9723883 | 0.83 | MAPT (0.49) | ALDH1A1POLBTSHRCASP1SMN1; SMN2 | |
| SCHEMBL9723882 | 0.83 | MAPT (0.49) | ALDH1A1POLBTSHRCASP1SMN1; SMN2 | |
| SCHEMBL11093809 | 0.81 | TSHR (0.60) | ALDH1A1POLBTSHRCASP1SMN1; SMN2 | |
| SCHEMBL7944697 | 0.81 | TSHR (0.60) | ALDH1A1POLBTSHRCASP1SMN1; SMN2 |
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-5169958-A | Reacting, 3-amino-2-propen-1-ones with magnesium halide in solvent | BASF AKTIENGESELLSCHAFT (DE) | 1992-12-08 | — | — | US | disclosed |