Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRA1D | P25100 | 1/20 | 0.34 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.34 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.34 |
| ▸ | DRD2 | P14416 | 1/20 | 0.33 |
| ▸ | DRD4 | P21917 | 1/20 | 0.33 |
| ▸ | DRD3 | P35462 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.33 |
| ▸ | MAPT | P10636 | 3/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | ABL1 | P00519 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | GLA | P06280 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | PKM | P14618 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL8629066 | 1.00 | ADRA1D (0.34) | ADRA1DADRA1AADRA1BDRD2DRD4 | |
| SCHEMBL8632343 | 0.84 | DGAT1 (0.35) | MAPTKMT2AABL1KDM4EGAA | |
| SCHEMBL8629071 | 0.83 | ALDH1A1 (0.42) | ALDH1A1MAPTKMT2AKDM4EMEN1 | |
| SCHEMBL8630195 | 0.81 | SLC6A9 (0.38) | ALDH1A1MAPTKDM4EGAATDP1 | |
| SCHEMBL8630198 | 0.81 | SLC6A9 (0.38) | ALDH1A1MAPTKDM4EGAATDP1 | |
| SCHEMBL8625850 | 0.76 | HPGD (0.32) | HPGDSMN1; SMN2 | |
| SCHEMBL8625853 | 0.76 | HPGD (0.32) | HPGDSMN1; SMN2 | |
| SCHEMBL8650094 | 0.76 | HPGD (0.36) | ALDH1A1MAPTKMT2AKDM4ELMNA | |
| SCHEMBL8650089 | 0.76 | HPGD (0.36) | ALDH1A1MAPTKMT2AKDM4ELMNA | |
| SCHEMBL4096751 | 0.75 | KDM4E (0.50) | ADRA1DADRA1AADRA1BALDH1A1MAPT |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0705243-B1 | BETA-AMINOVINYL KETONES, PREPARATION METHOD THEREFOR AND USE THEREOF FOR PREPARING BETA DIKETONES | RHONE POULENC AGROCHIMIE (FR) | 1998-06-24 | — | — | EP | disclosed |
| US-5684206-A | CONDENSING METHYL ORGANO KETONE WITH A BENZONITRILE IN PRESENCE OF STRONG BASE | RHONE-POULENC ARGOCHIMIE (FR) | 1997-11-04 | — | — | US | disclosed |
| EP-0705243-A1 | BETA-AMINOVINYL KETONES, PREPARATION METHOD THEREFOR AND USE THEREOF FOR PREPARING BETA DIKETONES | RHONE-POULENC AGROCHIMIE (FR) | 1996-04-10 | — | — | EP | disclosed |
| WO-1995000476-A1 | BETA-AMINOVINYL KETONES, PREPARATION METHOD THEREFOR AND USE THEREOF FOR PREPARING BETA DIKETONES | RHONE POULENC AGROCHIMIE (FR) | 1995-01-05 | — | — | WO | disclosed |