Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
| ▸ | CA2 | P00918 | 1/20 | 0.42 |
| ▸ | CA4 | P22748 | 1/20 | 0.42 |
| ▸ | CA5A | P35218 | 1/20 | 0.42 |
| ▸ | MAOA | P21397 | 2/20 | 0.42 |
| ▸ | MAOB | P27338 | 2/20 | 0.42 |
| ▸ | HTT | P42858 | 2/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 2/20 | 0.40 |
| ▸ | ESR1 | P03372 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.38 |
| ▸ | CFTR | P13569 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 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 | |
|---|---|---|---|---|
| SCHEMBL247027 | 0.84 | CA2 (0.55) | ALDH1A1TDP1CA2CA4CA5A | |
| SCHEMBL2678331 | 0.83 | ALDH1A1 (0.52) | ALDH1A1TDP1MAPK1CA2CA4 | |
| SCHEMBL6568180 | 0.83 | ALDH1A1 (0.52) | ALDH1A1TDP1MAPK1CA2CA4 | |
| SCHEMBL11868638 | 0.81 | ALDH1A1 (0.50) | ALDH1A1TDP1MAPK1CA2CA4 | |
| SCHEMBL21309077 | 0.79 | ALDH1A1 (0.61) | ALDH1A1TDP1MAPK1CA2CA4 | |
| SCHEMBL18577902 | 0.75 | ESR1 (0.58) | ALDH1A1TDP1MAPK1CA2CA4 | |
| SCHEMBL23279569 | 0.74 | ALDH1A1 (0.52) | ALDH1A1TDP1MAPK1HTTHPGD | |
| SCHEMBL18577919 | 0.73 | ESR1 (0.60) | ALDH1A1TDP1MAPK1CA2CA4 | |
| SCHEMBL11601777 | 0.72 | HPGD (0.59) | ALDH1A1MAPK1CA2HPGDGAA | |
| SCHEMBL4258684 | 0.71 | CYP2A6 (0.50) | ALDH1A1TDP1MAPK1CA2CYP2A6 |
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-111574564-A | Fluoroalkyl-substituted furyl diphosphine oxygen compound and preparation method thereof | 南京工业大学 | 2020-08-25 | — | — | CN | disclosed |
| CN-111560038-A | Fluoroalkyl-substituted furyl monophosphine oxide compound and preparation method thereof | 南京工业大学 | 2020-08-21 | — | — | CN | disclosed |