Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 6/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.47 |
| ▸ | TSHR | P16473 | 4/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.44 |
| ▸ | ATM | Q13315 | 1/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | MMP9 | P14780 | 1/20 | 0.41 |
| ▸ | MMP8 | P22894 | 1/20 | 0.41 |
| ▸ | MMP14 | P50281 | 1/20 | 0.41 |
| ▸ | CA2 | P00918 | 3/20 | 0.39 |
| ▸ | RECQL | P46063 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 3/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | NCOA1 | Q15788 | 1/20 | 0.34 |
| ▸ | NCOA3 | Q9Y6Q9 | 1/20 | 0.34 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.34 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.34 |
| ▸ | PRSS3 | P35030 | 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 | |
|---|---|---|---|---|
| SCHEMBL30910034 | 0.89 | CYP3A4 (0.55) | CYP3A4ALDH1A1TSHRTDP1ATM | |
| SCHEMBL18427246 | 0.86 | CYP3A4 (0.51) | CYP3A4ALDH1A1TSHRTDP1ATM | |
| SCHEMBL11123822 | 0.86 | CYP3A4 (0.51) | CYP3A4ALDH1A1TSHRTDP1ATM | |
| SCHEMBL13007639 | 0.86 | CYP3A4 (0.51) | CYP3A4ALDH1A1TSHRTDP1ATM | |
| SCHEMBL20653110 | 0.84 | CYP3A4 (0.50) | CYP3A4ALDH1A1TSHRTDP1ATM | |
| SCHEMBL18427203 | 0.84 | CYP3A4 (0.50) | CYP3A4ALDH1A1TSHRTDP1ATM | |
| SCHEMBL18427278 | 0.84 | CYP3A4 (0.50) | CYP3A4ALDH1A1TSHRTDP1ATM | |
| SCHEMBL20653184 | 0.82 | CYP3A4 (0.55) | CYP3A4ALDH1A1TSHRTDP1ATM | |
| SCHEMBL18954753 | 0.82 | CYP3A4 (0.55) | CYP3A4ALDH1A1TSHRTDP1ATM | |
| SCHEMBL12976464 | 0.82 | CYP3A4 (0.55) | CYP3A4ALDH1A1TSHRTDP1ATM |
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 |
|---|---|---|---|---|---|---|---|
| CN-102844417-B | Refrigeration oil and composition containing carbon dioxide refrigerant | CHEMTURA CORP | 2015-03-11 | — | — | CN | disclosed |
| EP-0284912-B1 | Elastomers containing polyamide and polyurea groups and procedure for the preparation of elastic, compact or cellular mouldings thereof | BASF AG (DE) | 1993-11-24 | — | — | EP | disclosed |
| EP-0284912-A2 | Elastomers containing polyamide and polyurea groups and procedure for the preparation of elastic, compact or cellular mouldings thereof | BASF Aktiengesellschaft (DE) | 1988-10-05 | — | — | EP | disclosed |
| EP-0133881-A1 | Aliphatic monoethers of 2,2-dimethylpropane-1,3-diol with C3 to C20 alkoxy groups, with the exception of 3-isopropoxy-2,2-dimethylpropane-1-ol and 3-tert.butoxy-2,2-dimethylpropane-1-ol, process for their production and their use as plasticizer alcohols | HÜLS AKTIENGESELLSCHAFT (DE) | 1985-03-13 | — | — | EP | disclosed |