Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PER2 | O15055 | 3/20 | 0.50 |
| ▸ | CRY1 | Q16526 | 3/20 | 0.50 |
| ▸ | CRY2 | Q49AN0 | 3/20 | 0.50 |
| ▸ | DRD4 | P21917 | 2/20 | 0.49 |
| ▸ | DRD2 | P14416 | 1/20 | 0.47 |
| ▸ | BMPR1B | O00238 | 1/20 | 0.42 |
| ▸ | BMPR1A | P36894 | 1/20 | 0.42 |
| ▸ | TGFBR1 | P36897 | 1/20 | 0.42 |
| ▸ | ACVRL1 | P37023 | 1/20 | 0.42 |
| ▸ | ACVR1 | Q04771 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.40 |
| ▸ | HPGD | P15428 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | CA12 | O43570 | 1/20 | 0.39 |
| ▸ | CA9 | Q16790 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | MTNR1A | P48039 | 2/20 | 0.35 |
| ▸ | MTNR1B | P49286 | 2/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | PSEN1 | P49768 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL20857619 | 0.82 | PER2 (0.52) | PER2CRY1CRY2ALDH1A1HPGD | |
| SCHEMBL17854044 | 0.81 | PER2 (0.47) | PER2CRY1CRY2DRD4DRD2 | |
| SCHEMBL20436348 | 0.79 | BMPR1B (0.49) | PER2CRY1CRY2DRD4BMPR1B | |
| SCHEMBL7606376 | 0.78 | DRD4 (0.50) | PER2CRY1CRY2DRD4DRD2 | |
| SCHEMBL28747047 | 0.78 | DRD4 (0.50) | PER2CRY1CRY2DRD4DRD2 | |
| SCHEMBL22655299 | 0.76 | BMPR1B (0.50) | PER2CRY1CRY2BMPR1BBMPR1A | |
| SCHEMBL17310455 | 0.76 | BMPR1B (0.39) | PER2CRY1CRY2DRD4DRD2 | |
| SCHEMBL23612415 | 0.75 | BMPR1B (0.52) | PER2CRY1CRY2BMPR1BBMPR1A | |
| SCHEMBL3319807 | 0.75 | DRD4 (0.42) | PER2CRY1CRY2DRD4DRD2 | |
| SCHEMBL904845 | 0.74 | OPRL1 (0.46) | ALDH1A1HPGDKDM4ECA12CA9 |
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-2022140428-A2 | INHIBITORS OF PEPTIDYLARGININE DEIMINASES | GILEAD SCIENCES, INC. (US) | 2022-06-30 | — | — | WO | disclosed |