Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.44 |
| ▸ | CYP3A5 | P20815 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 2/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
| ▸ | CYP17A1 | P05093 | 3/20 | 0.43 |
| ▸ | CYP19A1 | P11511 | 3/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.42 |
| ▸ | TBXAS1 | P24557 | 2/20 | 0.42 |
| ▸ | SLC6A2 | P23975 | 3/20 | 0.41 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.41 |
| ▸ | FAAH | O00519 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL6689108 | 0.90 | ALDH1A1 (0.46) | CYP3A4CYP3A5POLBMAPTHSD17B10 | |
| SCHEMBL28143235 | 0.82 | TP53 (0.53) | POLBTSHRMAPTSMN1; SMN2LMNA | |
| SCHEMBL28144222 | 0.79 | RAB9A (0.58) | CYP3A4POLBHSD17B10LMNAL3MBTL1 | |
| SCHEMBL15797709 | 0.78 | SLC6A4 (0.49) | SLC6A2SLC6A4CYP2D6SLC6A3 | |
| SCHEMBL4239134 | 0.78 | SLC6A3 (0.54) | CYP3A4TSHRSLC6A2SLC6A4LMNA | |
| SCHEMBL15797564 | 0.78 | CYP3A4 (0.51) | CYP3A4CYP3A5FAAH | |
| SCHEMBL24016014 | 0.77 | POLB (0.53) | CYP3A4POLBTSHRMAPTHSD17B10 | |
| SCHEMBL15797674 | 0.77 | CHRM1 (0.44) | MAPTLMNAALDH1A1 | |
| Hydrochloric Acid SCHEMBL15797820 | 0.77 | SLC6A4 (0.48) | SLC6A2SLC6A4CYP2D6SLC6A3 | |
| SCHEMBL14284025 | 0.75 | SMN1; SMN2 (0.50) | POLBSMN1; SMN2TBXAS1SLC6A2SLC6A4 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3355890-A1 | HUMAN PLASMA KALLIKREIN INHIBITORS | Biocryst Pharmaceuticals, Inc. (US) | 2018-08-08 | — | — | EP | disclosed |
| EP-3113772-A1 | HUMAN PLASMA KALLIKREIN INHIBITORS | Biocryst Pharmaceuticals, Inc. (US) | 2017-01-11 | — | — | EP | disclosed |
| WO-2015134998-A1 | HUMAN PLASMA KALLIKREIN INHIBITORS | BIOCRYST PHARMACEUTICALS, INC. (US) | 2015-09-11 | — | — | WO | disclosed |