Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
| ▸ | RAB9A | P51151 | 2/20 | 0.46 |
| ▸ | NPC1 | O15118 | 2/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.41 |
| ▸ | HPGD | P15428 | 3/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | CDC7 | O00311 | 1/20 | 0.40 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.40 |
| ▸ | DBF4 | Q9UBU7 | 1/20 | 0.40 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.40 |
| ▸ | MAPK9 | P45984 | 1/20 | 0.40 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL17870982 | 0.85 | RAB9A (0.48) | KMT2ARAB9ANPC1ALDH1A1HPGD | |
| SCHEMBL17870976 | 0.81 | KMT2A (0.49) | KMT2ARAB9ANPC1ALDH1A1HPGD | |
| SCHEMBL17870999 | 0.79 | NPC1 (0.47) | KMT2ARAB9ANPC1ALDH1A1HPGD | |
| SCHEMBL17871038 | 0.78 | KMT2A (0.46) | KMT2ARAB9ANPC1ALDH1A1HPGD | |
| SCHEMBL28172644 | 0.72 | KMT2A (0.49) | KMT2ARAB9ANPC1ALDH1A1HPGD | |
| SCHEMBL17871015 | 0.70 | HCAR3 (0.39) | KMT2ARAB9ANPC1ALDH1A1MAPT | |
| SCHEMBL17871019 | 0.69 | KMT2A (0.43) | KMT2ARAB9ANPC1ALDH1A1HPGD | |
| SCHEMBL4504653 | 0.68 | ALDH1A1 (0.51) | KMT2ARAB9ANPC1ALDH1A1HPGD | |
| SCHEMBL7296075 | 0.65 | TSHR (0.59) | KMT2ARAB9AALDH1A1HPGDMAPT | |
| SCHEMBL6353625 | 0.65 | HDAC3 (0.47) | KMT2ARAB9ANPC1ALDH1A1HPGD |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-107205394-A | New isothiazole acid amides, its preparation method and its purposes as fungicide | 拜耳作物科学股份公司 | 2017-09-26 | — | — | CN | disclosed |