Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 1/20 | 0.43 |
| ▸ | TBXAS1 | P24557 | 1/20 | 0.43 |
| ▸ | CES2 | O00748 | 4/20 | 0.42 |
| ▸ | CES1 | P23141 | 4/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | ATM | Q13315 | 1/20 | 0.39 |
| ▸ | NAAA | Q02083 | 1/20 | 0.39 |
| ▸ | ESR1 | P03372 | 1/20 | 0.38 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.37 |
| ▸ | BID | P55957 | 3/20 | 0.37 |
| ▸ | BCL2L1 | Q07817 | 3/20 | 0.37 |
| ▸ | MCL1 | Q07820 | 3/20 | 0.37 |
| ▸ | BAK1 | Q16611 | 3/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL28871639 | 0.88 | ATM (0.42) | PTGS2CES2CES1ALDH1A1CYP1A2 | |
| SCHEMBL24239040 | 0.87 | HDAC3 (0.46) | PTGS2TBXAS1CES2CES1ALDH1A1 | |
| SCHEMBL10369287 | 0.85 | ATM (0.37) | PTGS2TBXAS1CES2CES1ATM | |
| SCHEMBL10369288 | 0.85 | ATM (0.37) | PTGS2TBXAS1CES2CES1ATM | |
| SCHEMBL30088493 | 0.84 | PTGS2 (0.46) | PTGS2TBXAS1CES2CES1ALDH1A1 | |
| SCHEMBL6435901 | 0.84 | TBXAS1 (0.46) | PTGS2TBXAS1CES2CES1ALDH1A1 | |
| SCHEMBL6435892 | 0.84 | TBXAS1 (0.46) | PTGS2TBXAS1CES2CES1ALDH1A1 | |
| SCHEMBL6435904 | 0.84 | TBXAS1 (0.46) | PTGS2TBXAS1CES2CES1ALDH1A1 | |
| SCHEMBL6897257 | 0.80 | SIGMAR1 (0.54) | PTGS2TBXAS1ESR1SIGMAR1 | |
| SCHEMBL3962524 | 0.79 | ATM (0.45) | PTGS2CES2CES1ATMESR1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-1983004038-A1 | POLYESTER COMPOSITION | ETHYL CORPORATION (US) | 1983-11-24 | — | — | WO | disclosed |