Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.59 |
| ▸ | CES1 | P23141 | 2/20 | 0.50 |
| ▸ | CES2 | O00748 | 1/20 | 0.50 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.50 |
| ▸ | MEN1 | O00255 | 2/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.44 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | FNTA | P49354 | 1/20 | 0.42 |
| ▸ | FNTB | P49356 | 1/20 | 0.42 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | CTBP2 | P56545 | 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 | |
|---|---|---|---|---|
| SCHEMBL27618558 | 0.87 | CES1 (0.64) | ALDH1A1CES1CES2AKR1B1MEN1 | |
| SCHEMBL43943 | 0.87 | CES1 (0.64) | ALDH1A1CES1CES2AKR1B1MEN1 | |
| Benzene SCHEMBL11066939 | 0.87 | CES1 (0.64) | ALDH1A1CES1CES2AKR1B1MEN1 | |
| Benzene SCHEMBL7058395 | 0.87 | CES1 (0.64) | ALDH1A1CES1CES2AKR1B1MEN1 | |
| Benzene SCHEMBL3421936 | 0.87 | CES1 (0.64) | ALDH1A1CES1CES2AKR1B1MEN1 | |
| SCHEMBL1331954 | 0.87 | CES1 (0.64) | ALDH1A1CES1CES2AKR1B1MEN1 | |
| Benzene SCHEMBL2333780 | 0.87 | CES1 (0.64) | ALDH1A1CES1CES2AKR1B1MEN1 | |
| SCHEMBL9688483 | 0.87 | CES1 (0.64) | ALDH1A1CES1CES2AKR1B1MEN1 | |
| Benzene SCHEMBL10503945 | 0.87 | CES1 (0.64) | ALDH1A1CES1CES2AKR1B1MEN1 | |
| Benzene SCHEMBL6698503 | 0.87 | CES1 (0.64) | ALDH1A1CES1CES2AKR1B1MEN1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0609457-B1 | BENZENE DERIVATIVE | EISAI CO LTD (JP) | 1997-10-29 | — | — | EP | disclosed |
| US-5462958-A | Administering a cholesterol O-acyl transferase inhibitor | EISAI CO., LTD. (JP) | 1995-10-31 | — | — | US | disclosed |
| EP-0609457-A1 | BENZENE DERIVATIVE | Eisai Co., Ltd. (JP) | 1994-08-10 | — | — | EP | disclosed |
| CN-1084164-A | Benzene derivative | EISAI CO LTD (JP) | 1994-03-23 | — | — | CN | disclosed |