Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACE2 | Q9BYF1 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | GRM1 | Q13255 | 1/20 | 0.34 |
| ▸ | FABP3 | P05413 | 1/20 | 0.33 |
| ▸ | FABP4 | P15090 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.30 |
| ▸ | RXRB | P28702 | 1/20 | 0.30 |
| ▸ | GLRA3 | O75311 | 1/20 | 0.30 |
| ▸ | GLRB | P48167 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL6444165 | 0.76 | ACE2 (0.38) | ACE2ALDH1A1GRM1FABP3FABP4 | |
| SCHEMBL6446199 | 0.74 | ACE2 (0.35) | ACE2ALDH1A1GRM1FABP3FABP4 | |
| SCHEMBL11216320 | 0.74 | ACE2 (0.39) | ACE2ALDH1A1GRM1FABP3FABP4 | |
| SCHEMBL5695480 | 0.74 | ACE2 (0.39) | ACE2ALDH1A1GRM1FABP3FABP4 | |
| SCHEMBL21008764 | 0.73 | ACE2 (0.46) | ACE2ALDH1A1ALOX15 | |
| SCHEMBL27562387 | 0.71 | ALOX15 (0.39) | ALDH1A1ALOX15TDP1 | |
| SCHEMBL17797821 | 0.70 | ALDH1A1 (0.38) | ACE2ALDH1A1GRM1FABP3FABP4 | |
| SCHEMBL6445692 | 0.70 | ACE2 (0.39) | ACE2ALDH1A1GRM1FABP3FABP4 | |
| SCHEMBL6132208 | 0.69 | ACE2 (0.36) | ACE2ALDH1A1GRM1FABP3FABP4 | |
| SCHEMBL6446419 | 0.69 | ACE2 (0.38) | ACE2ALDH1A1GRM1FABP3FABP4 |
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-1194396-B1 | SELECTED CYCLOHEXANE-1,3- AND 1,4-DICARBOXYLIC ACID ESTERS | BASF AG (DE) | 2005-11-09 | — | — | EP | claimed |
| EP-1194396-B1 | SELECTED CYCLOHEXANE-1,3- AND 1,4-DICARBOXYLIC ACID ESTERS | BASF AG (DE) | 2005-11-09 | — | — | EP | disclosed |
| EP-1194396-A1 | SELECTED CYCLOHEXANE-1,3- AND 1,4-DICARBOXYLIC ACID ESTERS | BASF AKTIENGESELLSCHAFT (DE) | 2002-04-10 | — | — | EP | disclosed |
| WO-2000078704-A1 | SELECTED CYCLOHEXANE-1,3- AND 1,4-DICARBOXYLIC ACID ESTERS | BASF AKTIENGESELLSCHAFT (DE) | 2000-12-28 | — | — | WO | disclosed |