Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | BTK | Q06187 | 3/20 | 0.39 |
| ▸ | RORC | P51449 | 1/20 | 0.39 |
| ▸ | PPARD | Q03181 | 1/20 | 0.38 |
| ▸ | PPARA | Q07869 | 1/20 | 0.38 |
| ▸ | DGAT2 | Q96PD7 | 1/20 | 0.38 |
| ▸ | F10 | P00742 | 1/20 | 0.38 |
| ▸ | AR | P10275 | 1/20 | 0.37 |
| ▸ | ACHE | P22303 | 1/20 | 0.37 |
| ▸ | S100A4 | P26447 | 1/20 | 0.37 |
| ▸ | AURKA | O14965 | 1/20 | 0.37 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.37 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.37 |
| ▸ | JAK3 | P52333 | 3/20 | 0.36 |
| ▸ | LCK | P06239 | 2/20 | 0.36 |
| ▸ | EGFR | P00533 | 1/20 | 0.36 |
| ▸ | USP30 | Q70CQ3 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL29017688 | 0.89 | BTK (0.43) | KMT2AMEN1BTKPPARAS100A4 | |
| SCHEMBL29637977 | 0.89 | KMT2A (0.46) | KMT2AMEN1BTKRORCPPARD | |
| SCHEMBL29017746 | 0.89 | KMT2A (0.46) | KMT2AMEN1BTKRORCPPARD | |
| SCHEMBL29017665 | 0.88 | KMT2A (0.44) | KMT2AMEN1BTKRORCPPARD | |
| SCHEMBL29017702 | 0.86 | KMT2A (0.41) | KMT2AMEN1BTKAURKAPDPK1 | |
| SCHEMBL29637895 | 0.85 | PKM (0.43) | KMT2AMEN1BTKPPARDPPARA | |
| SCHEMBL29637909 | 0.84 | MCHR1 (0.44) | KMT2AMEN1BTKPPARDPPARA | |
| SCHEMBL29017731 | 0.84 | MCHR1 (0.44) | KMT2AMEN1BTKPPARDPPARA | |
| SCHEMBL29017652 | 0.84 | BTK (0.51) | BTKJAK3LCKEGFR | |
| SCHEMBL29017643 | 0.83 | MCHR1 (0.46) | KMT2AMEN1BTK |
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-114478478-B | N- (1- (6- (substituted phenyl) pyridazin-3-yl) piperidin-3-yl) amine/amide derivatives and process for preparing the same | 厦门大学 | 2023-06-13 | — | — | CN | disclosed |
| CN-114478478-A | N- (1- (6- (substituted phenyl) pyridazine-3-yl) piperidine-3-yl) amine/amide derivative and preparation method thereof | 厦门大学 | 2022-05-13 | — | — | CN | disclosed |