Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKT2 | P31751 | 2/20 | 0.62 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.62 |
| ▸ | PIM1 | P11309 | 1/20 | 0.51 |
| ▸ | HAO2 | Q9NYQ3 | 1/20 | 0.49 |
| ▸ | IKBKB | O14920 | 2/20 | 0.47 |
| ▸ | IKBKE | Q14164 | 1/20 | 0.46 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.44 |
| ▸ | IDO1 | P14902 | 2/20 | 0.44 |
| ▸ | ACVR1 | Q04771 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.43 |
| ▸ | CASP1 | P29466 | 1/20 | 0.43 |
| ▸ | CASP3 | P42574 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL20213984 | 1.00 | AKT2 (0.62) | AKT2CHEK1PIM1HAO2IKBKB | |
| SCHEMBL13035810 | 0.82 | AKT2 (0.67) | AKT2CHEK1HAO2IKBKBIKBKE | |
| SCHEMBL26832622 | 0.79 | AKT2 (0.62) | AKT2CHEK1HAO2IKBKBIKBKE | |
| SCHEMBL16115987 | 0.79 | IKBKB (0.71) | AKT2CHEK1HAO2IKBKBIKBKE | |
| SCHEMBL23780336 | 0.79 | PIN1 (0.50) | AKT2CHEK1HAO2NOTUMKMT2A | |
| SCHEMBL873114 | 0.77 | AKT2 (1.00) | AKT2CHEK1PIM1IKBKBIKBKE | |
| SCHEMBL24765276 | 0.77 | CHEK1 (0.59) | AKT2CHEK1IKBKENOTUMMAPT | |
| SCHEMBL26834432 | 0.77 | AKT2 (0.59) | AKT2CHEK1HAO2IKBKBIKBKE | |
| SCHEMBL24732319 | 0.77 | CHEK1 (0.59) | AKT2CHEK1HAO2IKBKBIKBKE | |
| SCHEMBL15653783 | 0.76 | AKT2 (0.57) | AKT2CHEK1HAO2IKBKBIKBKE |
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 |
|---|---|---|---|---|---|---|---|
| CN-118930533-A | Substituted pyrazole compounds and methods of using the same for treating hyperproliferative diseases | 班塔姆制药有限责任公司 | 2024-11-12 | — | — | CN | disclosed |
| CN-110603254-B | Substituted pyrazole compounds and methods of using the same for treating hyperproliferative diseases | 班塔姆制药有限责任公司 | 2024-04-12 | — | — | CN | disclosed |