Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.49 |
| ▸ | GSK3B | P49841 | 2/20 | 0.41 |
| ▸ | NPC1 | O15118 | 5/20 | 0.41 |
| ▸ | RAB9A | P51151 | 5/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.36 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.36 |
| ▸ | LCK | P06239 | 1/20 | 0.35 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.35 |
| ▸ | ATM | Q13315 | 1/20 | 0.35 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.35 |
| ▸ | LIMK1 | P53667 | 3/20 | 0.35 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.35 |
| ▸ | AURKA | O14965 | 1/20 | 0.35 |
| ▸ | DAPK3 | O43293 | 1/20 | 0.35 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.35 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.35 |
| ▸ | PAK4 | O96013 | 1/20 | 0.35 |
| ▸ | ABL1 | P00519 | 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 | |
|---|---|---|---|---|
| SCHEMBL12571407 | 0.86 | ALDH1A1 (0.50) | ALDH1A1NPC1RAB9ASMN1; SMN2MAPT | |
| SCHEMBL12571410 | 0.82 | ALDH1A1 (0.50) | ALDH1A1GSK3BNPC1RAB9ASMN1; SMN2 | |
| SCHEMBL6609203 | 0.81 | ALDH1A1 (0.72) | ALDH1A1GSK3BNPC1RAB9ASMN1; SMN2 | |
| SCHEMBL30664409 | 0.81 | ALDH1A1 (0.72) | ALDH1A1GSK3BNPC1RAB9ASMN1; SMN2 | |
| SCHEMBL17065303 | 0.76 | IKBKB (0.46) | ALDH1A1NPC1RAB9AMAPTHDAC1 | |
| SCHEMBL15002894 | 0.76 | ALDH1A1 (0.42) | ALDH1A1GSK3BNPC1RAB9ASMN1; SMN2 | |
| SCHEMBL29548990 | 0.74 | CYP3A4 (0.56) | ALDH1A1GSK3BNPC1RAB9ASMN1; SMN2 | |
| SCHEMBL5392323 | 0.74 | CYP3A4 (0.56) | ALDH1A1GSK3BNPC1RAB9ASMN1; SMN2 | |
| SCHEMBL24176348 | 0.74 | ALDH1A1 (0.45) | ALDH1A1GSK3BNPC1RAB9ASMN1; SMN2 | |
| SCHEMBL29548925 | 0.73 | ADORA3 (0.46) | ALDH1A1GSK3BNPC1RAB9ASMN1; SMN2 |
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-107266419-A | Specific amino pyridazine class, thing in combination, and its application method | 赛特凯恩蒂克公司 | 2017-10-20 | — | — | CN | disclosed |
| CN-103002897-B | Certain amino-pyridazines, compositions thereof, and methods of use thereof | 赛特凯恩蒂克公司 | 2017-06-09 | — | — | CN | disclosed |