Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C19 | P33261 | 1/20 | 0.58 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.47 |
| ▸ | PTGER1 | P34995 | 1/20 | 0.44 |
| ▸ | PTGER4 | P35408 | 1/20 | 0.44 |
| ▸ | PTGER3 | P43115 | 1/20 | 0.44 |
| ▸ | PTGER2 | P43116 | 1/20 | 0.44 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.42 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.42 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.42 |
| ▸ | HDAC7 | Q8WUI4 | 2/20 | 0.42 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.42 |
| ▸ | HDAC10 | Q969S8 | 2/20 | 0.42 |
| ▸ | HDAC11 | Q96DB2 | 2/20 | 0.42 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.42 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.42 |
| ▸ | HDAC9 | Q9UKV0 | 2/20 | 0.42 |
| ▸ | HDAC5 | Q9UQL6 | 2/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL17381514 | 1.00 | CYP2C19 (0.58) | CYP2C19MAPTRXFP1PTGER1PTGER4 | |
| Cpi 613 SCHEMBL13333201 | 0.99 | CYP2C19 (0.59) | CYP2C19MAPTRXFP1PTGER1PTGER4 | |
| Cpi 613 SCHEMBL1062218 | 0.99 | CYP2C19 (0.59) | CYP2C19MAPTRXFP1PTGER1PTGER4 | |
| SCHEMBL10307745 | 0.91 | CYP2C19 (0.50) | CYP2C19PTGER1PTGER4PTGER3PTGER2 | |
| SCHEMBL20395792 | 0.90 | CYP2C19 (0.63) | CYP2C19MAPTRXFP1PTGER1PTGER4 | |
| SCHEMBL10307777 | 0.90 | CYP2C19 (0.52) | CYP2C19MAPTRXFP1PTGER1PTGER4 | |
| SCHEMBL22299026 | 0.89 | CYP2C19 (0.48) | CYP2C19MAPTRXFP1PTGER1PTGER4 | |
| SCHEMBL13333202 | 0.89 | CYP2C19 (0.50) | CYP2C19PTGER1PTGER4PTGER3PTGER2 | |
| SCHEMBL28677430 | 0.89 | CYP2C19 (0.48) | CYP2C19MAPTRXFP1PTGER1PTGER4 | |
| Cpi 613 SCHEMBL26613507 | 0.88 | CYP2C19 (0.54) | CYP2C19MAPTRXFP1PTGER1PTGER4 |
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-3189033-B1 | PHARMACEUTICAL COMPOUNDS | RAFAEL PHARMACEUTICALS INC (US) | 2020-08-05 | — | — | EP | disclosed |