Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A1 | P04798 | 2/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.46 |
| ▸ | CYP1B1 | Q16678 | 2/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.45 |
| ▸ | NPC1 | O15118 | 2/20 | 0.43 |
| ▸ | RAB9A | P51151 | 2/20 | 0.43 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.43 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.43 |
| ▸ | ACHE | P22303 | 1/20 | 0.42 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 3/20 | 0.42 |
| ▸ | MAPT | P10636 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | CA1 | P00915 | 1/20 | 0.41 |
| ▸ | CA2 | P00918 | 1/20 | 0.41 |
| ▸ | CA7 | P43166 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL8029394 | 0.87 | ACHE (0.54) | CYP1A2ALDH1A1NPC1RAB9ADYRK1A | |
| SCHEMBL18575649 | 0.85 | CA4 (0.52) | CYP1A2ALDH1A1NPC1RAB9AACHE | |
| Hydrochloric Acid SCHEMBL28248413 | 0.85 | ACHE (0.52) | ALDH1A1NPC1RAB9ADYRK1ACLK4 | |
| Hydrochloric Acid SCHEMBL2154395 | 0.85 | ACHE (0.52) | ALDH1A1NPC1RAB9ADYRK1ACLK4 | |
| Hydrochloric Acid SCHEMBL2155238 | 0.83 | CA4 (0.50) | CYP1A2ALDH1A1NPC1RAB9AACHE | |
| SCHEMBL27265881 | 0.83 | CYP1A2 (0.47) | CYP1A1CYP1A2CYP1B1CYP2D6ALDH1A1 | |
| SCHEMBL27268769 | 0.79 | CYP1A2 (0.53) | CYP1A1CYP1A2CYP1B1CYP2D6ALDH1A1 | |
| SCHEMBL27268061 | 0.79 | CLK4 (0.51) | ALDH1A1NPC1RAB9ADYRK1ACLK4 | |
| SCHEMBL27269274 | 0.75 | DYRK1A (0.47) | ALDH1A1NPC1RAB9ADYRK1ACLK4 | |
| SCHEMBL27702748 | 0.75 | ALDH1A1 (0.52) | ALDH1A1NPC1RAB9AACHENFE2L2 |
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-1019193-B | Process for carbonylation of ethylenically unsaturated compounds with palladium catalyst | SHELL INT RESEARCH (NL) | 1992-11-25 | — | — | CN | disclosed |
| CN-88101206-A | The method of the carbonylation of ethylenically unsaturated compounds under palladium catalyst | — | 1988-09-28 | — | — | CN | disclosed |