Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.37 |
| ▸ | HTR1A | P08908 | 2/20 | 0.33 |
| ▸ | HTR7 | P34969 | 2/20 | 0.33 |
| ▸ | HTR2B | P41595 | 2/20 | 0.33 |
| ▸ | TMEM97 | Q5BJF2 | 2/20 | 0.33 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.33 |
| ▸ | MAPT | P10636 | 3/20 | 0.33 |
| ▸ | MEN1 | O00255 | 3/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.30 |
| ▸ | LMNA | P02545 | 1/20 | 0.30 |
| ▸ | THRB | P10828 | 1/20 | 0.30 |
| ▸ | APEX1 | P27695 | 1/20 | 0.30 |
| ▸ | HTT | P42858 | 1/20 | 0.30 |
| ▸ | RECQL | P46063 | 1/20 | 0.30 |
| ▸ | TSHR | P16473 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL28579068 | 0.91 | HPRT1 (0.40) | ALDH1A1CYP2A6HTR1AHTR7HTR2B | |
| SCHEMBL2270952 | 0.83 | ALDH1A1 (0.35) | ALDH1A1CYP2A6HTR1AHTR7HTR2B | |
| SCHEMBL28575128 | 0.81 | TRPM4 (0.33) | ALDH1A1CYP2A6KDM4EMAPTMEN1 | |
| SCHEMBL28546786 | 0.78 | TSHR (0.31) | TSHR | |
| SCHEMBL20098739 | 0.78 | MEN1 (0.39) | ALDH1A1KDM4EMEN1KMT2ALMNA | |
| SCHEMBL29586872 | 0.78 | LPL (0.44) | ALDH1A1CYP2A6KDM4EMAPTMEN1 | |
| SCHEMBL476862 | 0.78 | LPL (0.44) | ALDH1A1CYP2A6KDM4EMAPTMEN1 | |
| SCHEMBL22793668 | 0.77 | LPL (0.39) | ALDH1A1CYP2A6HTR1AHTR7HTR2B | |
| SCHEMBL29592069 | 0.77 | TAAR1 (0.33) | ALDH1A1LMNATSHR | |
| SCHEMBL29592082 | 0.77 | ALDH1A1 (0.30) | ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-112047913-A | Fluorine-containing complex compound and method for producing fluorine-containing organic compound using same | 大金工业株式会社 | 2020-12-08 | — | — | CN | disclosed |
| CN-111961068-A | Fluorine-containing complex compound and method for producing fluorine-containing organic compound using same | 大金工业株式会社 | 2020-11-20 | — | — | CN | disclosed |