Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DGAT1 | O75907 | 1/20 | 0.55 |
| ▸ | PARP10 | Q53GL7 | 4/20 | 0.43 |
| ▸ | PARP15 | Q460N3 | 2/20 | 0.43 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | PARP14 | Q460N5 | 1/20 | 0.40 |
| ▸ | CES2 | O00748 | 1/20 | 0.38 |
| ▸ | CES1 | P23141 | 1/20 | 0.38 |
| ▸ | MAP2K2 | P36507 | 2/20 | 0.37 |
| ▸ | MAP2K1 | Q02750 | 2/20 | 0.37 |
| ▸ | CA1 | P00915 | 2/20 | 0.37 |
| ▸ | CA2 | P00918 | 2/20 | 0.37 |
| ▸ | MAOA | P21397 | 1/20 | 0.37 |
| ▸ | MAOB | P27338 | 1/20 | 0.37 |
| ▸ | RPS6KB1 | P23443 | 3/20 | 0.36 |
| ▸ | AURKA | O14965 | 2/20 | 0.36 |
| ▸ | AKT1 | P31749 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | XBP1 | P17861 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL15729805 | 0.83 | DGAT1 (0.56) | DGAT1PARP10PARP15MAPK8LMNA | |
| SCHEMBL31413134 | 0.83 | DGAT1 (0.56) | DGAT1PARP10PARP15MAPK8LMNA | |
| SCHEMBL17315189 | 0.81 | DGAT1 (0.55) | DGAT1PARP10PARP15MAPK8LMNA | |
| Hydrochloric Acid SCHEMBL17091113 | 0.81 | DGAT1 (0.55) | DGAT1PARP10PARP15MAPK8LMNA | |
| SCHEMBL10211142 | 0.81 | DGAT1 (0.55) | DGAT1PARP10PARP15MAPK8LMNA | |
| SCHEMBL31510727 | 0.80 | SRD5A2 (0.54) | DGAT1PARP10PARP15MAPK8LMNA | |
| SCHEMBL29893781 | 0.79 | DGAT1 (0.51) | DGAT1PARP10PARP15MAPK8LMNA | |
| SCHEMBL16597394 | 0.77 | GAA (0.51) | HTTMAOAMAOB | |
| SCHEMBL10160106 | 0.77 | DGAT1 (0.50) | DGAT1PARP10PARP15LMNAHTT | |
| SCHEMBL27894200 | 0.77 | PLA2G2A (0.56) | DGAT1PARP10PARP15LMNAHTT |
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 |
|---|---|---|---|---|---|---|---|
| EP-3558981-B1 | PYRAN DERIVATIVES AS CYP11A1 (CYTOCHROME P450 MONOOXYGENASE 11A1) INHIBITORS | ORION CORP (FI) | 2021-05-26 | — | — | EP | disclosed |