Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.45 |
| ▸ | MAPT | P10636 | 3/20 | 0.45 |
| ▸ | CASP1 | P29466 | 1/20 | 0.45 |
| ▸ | CASP7 | P55210 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 3/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 3/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL9729226 | 1.00 | ALDH1A1 (0.45) | ALDH1A1KDM4EMAPTCASP1CASP7 | |
| SCHEMBL4431602 | 0.79 | ALDH1A1 (0.51) | ALDH1A1KDM4EMAPTCASP1CASP7 | |
| SCHEMBL9636564 | 0.79 | ALDH1A1 (0.44) | ALDH1A1KDM4EMAPTCASP1CASP7 | |
| SCHEMBL10883941 | 0.78 | ALDH1A1 (0.41) | ALDH1A1KDM4EMAPTCASP1CASP7 | |
| SCHEMBL1415765 | 0.76 | ALDH1A1 (0.46) | ALDH1A1KDM4EMAPTMEN1KMT2A | |
| SCHEMBL4857509 | 0.74 | ALDH1A1 (0.42) | ALDH1A1KDM4EMAPTMEN1KMT2A | |
| SCHEMBL4857506 | 0.74 | ALDH1A1 (0.42) | ALDH1A1KDM4EMAPTMEN1KMT2A | |
| SCHEMBL11038700 | 0.74 | MEN1 (0.43) | ALDH1A1KDM4EMAPTMEN1KMT2A | |
| SCHEMBL916946 | 0.74 | ALDH1A1 (0.44) | ALDH1A1KDM4EMAPTCASP1CASP7 | |
| SCHEMBL9636502 | 0.74 | ALDH1A1 (0.41) | ALDH1A1KDM4EMAPTCASP1CASP7 |
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 |
|---|---|---|---|---|---|---|---|
| US-5102793-A | STEREOSPECIFIC KETO REDUCTION OF BICYCLOOCTANDIONE-CARBOXYLIC ACID ESTERS BY MICROORGANISMS | SCHERING AKTIENGESELLSCHAFT (DE) | 1992-04-07 | — | — | US | disclosed |
| EP-0033863-A1 | Process for the production of cis-bicyclo (3.3.0)octane-3,7-dione, and its use | MERCK PATENT GmbH (DE) | 1981-08-19 | — | — | EP | disclosed |