Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS1 | P23219 | 1/20 | 0.44 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.44 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.42 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | PDK2 | Q15119 | 2/20 | 0.40 |
| ▸ | MAOB | P27338 | 3/20 | 0.40 |
| ▸ | ATM | Q13315 | 1/20 | 0.40 |
| ▸ | MAOA | P21397 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | ESR1 | P03372 | 2/20 | 0.40 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | ABL1 | P00519 | 1/20 | 0.38 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.38 |
| ▸ | HRH3 | Q9Y5N1 | 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 | |
|---|---|---|---|---|
| SCHEMBL6224120 | 0.83 | PARP10 (0.44) | PTGS1PTGS2PARP10PDK2MAOB | |
| SCHEMBL172836 | 0.83 | PTGS1 (0.44) | PTGS1PTGS2PARP10TDP1PDK2 | |
| SCHEMBL11587463 | 0.81 | MEN1 (0.47) | PTGS1PTGS2PARP10PDK2MAOB | |
| SCHEMBL1049033 | 0.81 | PDK2 (0.44) | PTGS1PTGS2PARP10PDK2MAOB | |
| SCHEMBL17130522 | 0.79 | PARP10 (0.44) | PTGS1PTGS2PARP10TDP1PDK2 | |
| SCHEMBL6566407 | 0.79 | PTGS1 (0.51) | PTGS1PTGS2PARP10PDK2MAOB | |
| SCHEMBL16484216 | 0.79 | NPC1 (0.47) | PTGS1PTGS2MAOBHRH3 | |
| SCHEMBL8293069 | 0.79 | PTGS1 (0.41) | PTGS1PTGS2PARP10TDP1PDK2 | |
| SCHEMBL12476213 | 0.79 | PTGS1 (0.41) | PTGS1PTGS2PARP10PDK2MAOB | |
| SCHEMBL30072838 | 0.79 | PTGS1 (0.41) | PTGS1PTGS2PARP10TDP1PDK2 |
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-2010127208-A1 | INHIBITORS OF ACETYL-COA CARBOXYLASE | FOREST LABORATORIES HOLDINGS LIMITED (BM) | 2010-11-04 | — | — | WO | disclosed |