Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 2/20 | 0.65 |
| ▸ | RAB9A | P51151 | 2/20 | 0.65 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.54 |
| ▸ | MEN1 | O00255 | 1/20 | 0.54 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.54 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.54 |
| ▸ | CA1 | P00915 | 1/20 | 0.54 |
| ▸ | CA2 | P00918 | 1/20 | 0.54 |
| ▸ | MIF | P14174 | 1/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.49 |
| ▸ | LMNA | P02545 | 2/20 | 0.49 |
| ▸ | HPGD | P15428 | 2/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.49 |
| ▸ | HTT | P42858 | 1/20 | 0.48 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL12294594 | 0.86 | NPC1 (0.65) | NPC1RAB9AKMT2AMEN1CYP1A2 | |
| SCHEMBL3326726 | 0.85 | LMNA (0.53) | NPC1RAB9AMIFALDH1A1LMNA | |
| SCHEMBL5994929 | 0.85 | POLB (0.56) | NPC1RAB9ACYP1A2CYP2C19MIF | |
| SCHEMBL14183685 | 0.85 | NPC1 (0.52) | NPC1RAB9AMIF | |
| SCHEMBL4951608 | 0.85 | LMNA (0.53) | NPC1RAB9AMIFALDH1A1LMNA | |
| SCHEMBL3326724 | 0.85 | LMNA (0.53) | NPC1RAB9AMIFALDH1A1LMNA | |
| SCHEMBL14183637 | 0.85 | MIF (0.54) | NPC1RAB9AKMT2AMEN1CYP1A2 | |
| SCHEMBL3984065 | 0.85 | NPC1 (0.59) | NPC1RAB9AKMT2AMEN1CYP1A2 | |
| SCHEMBL6022384 | 0.84 | MEN1 (0.56) | NPC1RAB9AKMT2AMEN1CYP1A2 | |
| SCHEMBL7503049 | 0.83 | MIF (0.49) | NPC1RAB9AMIF |
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-112745312-B | Pyridazinone isoxazole methyl ether compound and application thereof | 沈阳中化农药化工研发有限公司 | 2022-08-30 | — | — | CN | disclosed |
| CN-112745312-A | Pyridazinone isoxazole methyl ether compound and application thereof | 沈阳中化农药化工研发有限公司 | 2021-05-04 | — | — | CN | disclosed |