Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PLK1 | P53350 | 1/20 | 0.51 |
| ▸ | NPC1 | O15118 | 3/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.48 |
| ▸ | RAB9A | P51151 | 1/20 | 0.47 |
| ▸ | POLB | P06746 | 2/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.47 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.47 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.47 |
| ▸ | NQO1 | P15559 | 1/20 | 0.47 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.45 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 3/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL9476412 | 0.89 | PLK1 (0.50) | PLK1NPC1ALDH1A1CYP1A2KDM4E | |
| SCHEMBL9475903 | 0.89 | PLK1 (0.46) | PLK1NPC1ALDH1A1CYP1A2KDM4E | |
| SCHEMBL9474430 | 0.86 | PLK1 (0.44) | PLK1NPC1ALDH1A1CYP1A2KDM4E | |
| SCHEMBL9475762 | 0.83 | TP53 (0.54) | — | |
| SCHEMBL9475911 | 0.82 | MAPT (0.50) | PLK1NPC1ALDH1A1CYP1A2RAB9A | |
| SCHEMBL16573638 | 0.81 | PLK1 (0.53) | PLK1NPC1ALDH1A1CYP1A2KDM4E | |
| SCHEMBL28275183 | 0.81 | PLK1 (0.53) | PLK1NPC1ALDH1A1CYP1A2KDM4E | |
| SCHEMBL21784949 | 0.80 | LTA4H (0.50) | PLK1NPC1ALDH1A1CYP1A2KDM4E | |
| SCHEMBL9476200 | 0.78 | CES1 (0.42) | NPC1ALDH1A1CYP1A2RAB9APOLB | |
| SCHEMBL9475464 | 0.77 | MAPT (0.47) | NPC1ALDH1A1CYP1A2RAB9APOLB |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5243066-A | ALKYL 2-ARYL-2,2-DIALKOXYACETATES, THE PREPARATION THEREOF AND A METHOD OF USING THEM FOR PREPARING ARYLGLYOXYLIC ESTERS | BASF AKTIENGESELLSCHAFT (DE) | 1993-09-07 | — | — | US | disclosed |