Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES1 | P23141 | 1/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 2/20 | 0.42 |
| ▸ | RAB9A | P51151 | 2/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | LTA4H | P09960 | 2/20 | 0.42 |
| ▸ | PPARA | Q07869 | 1/20 | 0.41 |
| ▸ | ELANE | P08246 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.40 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.40 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.40 |
| ▸ | PDK3 | Q15120 | 1/20 | 0.40 |
| ▸ | PDK4 | Q16654 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL9475849 | 0.86 | CES1 (0.53) | CES1SMN1; SMN2HPGDNPC1RAB9A | |
| SCHEMBL9474980 | 0.84 | NPC1 (0.44) | SMN1; SMN2HPGDNPC1RAB9AL3MBTL1 | |
| SCHEMBL9475898 | 0.84 | MAPT (0.46) | CES1SMN1; SMN2NPC1RAB9AL3MBTL1 | |
| SCHEMBL9474748 | 0.83 | CES1 (0.38) | CES1SMN1; SMN2L3MBTL1MEN1ALDH1A1 | |
| SCHEMBL9475755 | 0.81 | NPC1 (0.51) | CES1SMN1; SMN2HPGDNPC1RAB9A | |
| SCHEMBL9475439 | 0.80 | MAPT (0.41) | CES1SMN1; SMN2NPC1RAB9AL3MBTL1 | |
| SCHEMBL9474430 | 0.79 | PLK1 (0.44) | SMN1; SMN2HPGDNPC1RAB9AMEN1 | |
| SCHEMBL3184688 | 0.75 | PPARA (0.53) | SMN1; SMN2HPGDNPC1RAB9AL3MBTL1 | |
| SCHEMBL3191632 | 0.74 | SMN1; SMN2 (0.51) | SMN1; SMN2HPGDNPC1RAB9AL3MBTL1 | |
| SCHEMBL9476583 | 0.73 | TP53 (0.50) | — |
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 |