Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 2/20 | 0.45 |
| ▸ | FAAH | O00519 | 6/20 | 0.42 |
| ▸ | CES1 | P23141 | 5/20 | 0.42 |
| ▸ | CES2 | O00748 | 2/20 | 0.42 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | S1PR2 | O95136 | 1/20 | 0.34 |
| ▸ | S1PR4 | O95977 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | TP53 | P04637 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | XBP1 | P17861 | 1/20 | 0.34 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL6927178 | 0.84 | KMT2A (0.46) | ALDH1A1MAPT | |
| SCHEMBL6927170 | 0.84 | KMT2A (0.46) | ALDH1A1MAPT | |
| SCHEMBL6471289 | 0.83 | KMT2A (0.48) | ALDH1A1MAPT | |
| SCHEMBL19385572 | 0.74 | CES2 (0.58) | CA2FAAHCES1CES2ESR1 | |
| SCHEMBL8957770 | 0.74 | CA2 (0.54) | CA2FAAHCES1CES2 | |
| SCHEMBL466032 | 0.74 | CA2 (0.48) | CA2FAAHCES1CES2NPC1 | |
| SCHEMBL9941 | 0.74 | CA2 (0.64) | CA2FAAHCES1CES2ESR1 | |
| SCHEMBL28917048 | 0.72 | CA2 (0.52) | CA2FAAHCES1CES2ALDH1A1 | |
| Alcohol SCHEMBL8778794 | 0.72 | CA2 (0.56) | CA2FAAHCES1CES2ALDH1A1 | |
| Fluoride SCHEMBL25435314 | 0.71 | CA2 (0.61) | CA2FAAHCES1CES2ESR1 |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| JP-62059257-A | — | — | None | — | — | JP | disclosed |
| JP-60158126-A | — | — | None | — | — | JP | disclosed |
| JP-S6259257-A | CIS-TYPE ISOPRENOID | EISAI CO LTD | 1987-03-14 | — | — | JP | disclosed |
| JP-S60158126-A | CIS-TYPE ISOPRENOID | EISAI CO LTD | 1985-08-19 | — | — | JP | disclosed |
| EP-0021382-B1 | PROCESS FOR THE PRODUCTION OF CYCLOPROPANE CARBOXYLIC ACID DERIVATIVES, INTERMEDIATES THEREFOR AND PROCESS FOR THEIR PRODUCTION | BAYER AG (DE) | 1982-04-28 | — | — | EP | disclosed |
| EP-0021382-A1 | Process for the production of cyclopropane carboxylic acid derivatives, intermediates therefor and process for their production | BAYER AG (DE) | 1981-01-07 | — | — | EP | disclosed |