Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOA | P21397 | 1/20 | 0.43 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.36 |
| ▸ | ACHE | P22303 | 2/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.33 |
| ▸ | CYP2E1 | P05181 | 1/20 | 0.33 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | CCR1 | P32246 | 1/20 | 0.32 |
| ▸ | CCR5 | P51681 | 1/20 | 0.32 |
| ▸ | CCR8 | P51685 | 1/20 | 0.32 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.32 |
| ▸ | TGFBR1 | P36897 | 1/20 | 0.30 |
| ▸ | BRD4 | O60885 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL20379646 | 0.80 | MAOA (0.43) | MAOALRRK2ACHECYP2E1CYP2A6 | |
| SCHEMBL15388882 | 0.78 | MAOA (0.42) | MAOALRRK2ACHECYP2E1CYP2A6 | |
| SCHEMBL23104778 | 0.78 | MAOA (0.42) | MAOALRRK2ACHECYP2E1CYP2A6 | |
| SCHEMBL23114543 | 0.77 | MAOA (0.41) | MAOALRRK2ACHECYP2E1CYP2A6 | |
| SCHEMBL23103531 | 0.76 | MAOA (0.40) | MAOALRRK2ACHECYP2E1CYP2A6 | |
| SCHEMBL23107521 | 0.69 | PIM1 (0.37) | LRRK2TGFBR1 | |
| SCHEMBL15829876 | 0.67 | CYP1A2 (0.49) | LRRK2CYP1A2CYP2E1CYP2A6CYP2C9 | |
| SCHEMBL14165040 | 0.66 | ACHE (0.40) | MAOAACHECYP2E1CYP2A6CYP2C9 | |
| SCHEMBL13139736 | 0.66 | IDO1 (0.44) | CYP1A2CYP2C19CCR1CCR5CCR8 | |
| SCHEMBL13680761 | 0.65 | ACHE (0.44) | ACHECYP1A2CYP2A6CYP2C9CYP2C19 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2022174253-A1 | HPK1 ANTAGONISTS AND USES THEREOF | Nimbus Saturn, Inc. (US) | 2022-08-18 | — | — | WO | disclosed |
| WO-2021050964-A1 | HPK1 ANTAGONISTS AND USES THEREOF | Nimbus Saturn, Inc. (US) | 2021-03-18 | — | — | WO | disclosed |