Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAP4K1 | Q92918 | 3/20 | 0.49 |
| ▸ | NCOA3 | Q9Y6Q9 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.40 |
| ▸ | CDK9 | P50750 | 1/20 | 0.40 |
| ▸ | HASPIN | Q8TF76 | 1/20 | 0.40 |
| ▸ | CYP11B1 | P15538 | 3/20 | 0.37 |
| ▸ | CYP11B2 | P19099 | 3/20 | 0.37 |
| ▸ | DYRK1A | Q13627 | 6/20 | 0.35 |
| ▸ | CLK1 | P49759 | 5/20 | 0.35 |
| ▸ | CLK2 | P49760 | 5/20 | 0.35 |
| ▸ | CLK4 | Q9HAZ1 | 5/20 | 0.35 |
| ▸ | DYRK1B | Q9Y463 | 4/20 | 0.35 |
| ▸ | CDK5 | Q00535 | 4/20 | 0.35 |
| ▸ | CDK5R1 | Q15078 | 4/20 | 0.35 |
| ▸ | CLK3 | P49761 | 3/20 | 0.35 |
| ▸ | PIM2 | Q9P1W9 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL29930315 | 1.00 | MAP4K1 (0.49) | MAP4K1NCOA3HTTCCNT1CDK9 | |
| SCHEMBL28925081 | 0.78 | MAP4K1 (0.43) | MAP4K1DYRK1AALDH1A1 | |
| SCHEMBL28635707 | 0.77 | MAP4K1 (0.43) | MAP4K1NCOA3CYP11B2ALDH1A1 | |
| SCHEMBL28634082 | 0.76 | MAP4K1 (0.43) | MAP4K1ALDH1A1KDM4EGAA | |
| SCHEMBL18050177 | 0.75 | CCNT1 (0.53) | NCOA3HTTCCNT1CDK9HASPIN | |
| SCHEMBL23301805 | 0.69 | F7 (0.38) | ALDH1A1SMN1; SMN2KDM4E | |
| SCHEMBL29897403 | 0.69 | F7 (0.38) | ALDH1A1SMN1; SMN2KDM4E | |
| SCHEMBL28633555 | 0.69 | MAP4K1 (0.42) | MAP4K1HTTCYP11B1CYP11B2 | |
| SCHEMBL23962778 | 0.68 | MAP4K1 (0.41) | MAP4K1GAA | |
| SCHEMBL28284386 | 0.68 | MAP4K1 (0.38) | MAP4K1CYP11B1CYP11B2KDM4EHPGD |
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 |
|---|---|---|---|---|---|---|---|
| CN-115244050-B | Novel HPK1 inhibitor and preparation method and application thereof | 轶诺(浙江)药业有限公司 | 2024-06-21 | — | — | CN | disclosed |
| CN-115244050-A | Novel HPK1 inhibitor and preparation method and application thereof | 轶诺(浙江)药业有限公司 | 2022-10-25 | — | — | CN | disclosed |
| CN-113336747-A | Novel HPK1 inhibitor and preparation method and application thereof | 轶诺(浙江)药业有限公司 | 2021-09-03 | — | — | CN | disclosed |