Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOA | P21397 | 3/20 | 0.44 |
| ▸ | MAOB | P27338 | 3/20 | 0.44 |
| ▸ | NISCH | Q9Y2I1 | 1/20 | 0.44 |
| ▸ | ADRA2A | P08913 | 5/20 | 0.43 |
| ▸ | ADRA2B | P18089 | 5/20 | 0.43 |
| ▸ | ADRA2C | P18825 | 5/20 | 0.43 |
| ▸ | KCNN4 | O15554 | 1/20 | 0.42 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.38 |
| ▸ | GRM5 | P41594 | 1/20 | 0.38 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.37 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.37 |
| ▸ | CASP1 | P29466 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 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 | |
|---|---|---|---|---|
| SCHEMBL2042815 | 0.82 | ADRA2A (0.43) | MAOAMAOBNISCHADRA2AADRA2B | |
| SCHEMBL351538 | 0.81 | ADRA2A (0.34) | NISCHADRA2AADRA2BADRA2CKCNN4 | |
| Hydrochloric Acid SCHEMBL28113238 | 0.81 | TAAR1 (0.44) | MAOAMAOBNISCHADRA2AADRA2B | |
| SCHEMBL8379947 | 0.77 | HDAC3 (0.39) | MAOAMAOBKCNN4KCNH2 | |
| SCHEMBL27678689 | 0.75 | TAAR1 (0.43) | KCNN4TAAR1 | |
| SCHEMBL9219543 | 0.74 | ADRA2A (0.31) | ADRA2AADRA2BADRA2C | |
| SCHEMBL353044 | 0.72 | ADRA2A (0.32) | ADRA2AADRA2BADRA2C | |
| SCHEMBL351887 | 0.72 | ADRA2A (0.32) | ADRA2AADRA2BADRA2C | |
| SCHEMBL11161143 | 0.72 | ADRA2A (0.41) | ADRA2AADRA2BADRA2CKCNN4CYP2D6 | |
| Fluoride SCHEMBL27972865 | 0.71 | ALDH1A1 (0.65) | MAOAMAOBKCNH2TAAR1ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2022200360-A1 | INVERSE THERMOGELLING POLYOXAZOLINE COPOLYMERS | JULIUS-MAXIMILIANS-UNIVERSITÄT WÜRZBURG (DE) | 2022-09-29 | — | — | WO | disclosed |
| WO-2022200360-A1 | INVERSE THERMOGELLING POLYOXAZOLINE COPOLYMERS | JULIUS-MAXIMILIANS-UNIVERSITÄT WÜRZBURG (DE) | 2022-09-29 | — | — | WO | disclosed |
| CN-113999131-B | Method for preparing amide derivative by amination of alkyl C-H bond under catalysis of nickel promoted by visible light | 苏州大学 | 2022-06-28 | — | — | CN | disclosed |
| CN-113999131-A | Method for preparing amide derivative by amination of alkyl C-H bond under catalysis of nickel promoted by visible light | 苏州大学 | 2022-02-01 | — | — | CN | disclosed |