Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.48 |
| ▸ | POLB | P06746 | 1/20 | 0.48 |
| ▸ | MAPT | P10636 | 4/20 | 0.44 |
| ▸ | THRB | P10828 | 1/20 | 0.44 |
| ▸ | ADORA3 | P0DMS8 | 10/20 | 0.43 |
| ▸ | TNKS | O95271 | 1/20 | 0.41 |
| ▸ | PARP1 | P09874 | 1/20 | 0.41 |
| ▸ | TNKS2 | Q9H2K2 | 1/20 | 0.41 |
| ▸ | XDH | P47989 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | ADORA1 | P30542 | 4/20 | 0.39 |
| ▸ | ADORA2A | P29274 | 3/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL29645578 | 0.91 | MAPT (0.46) | KDM4EALDH1A1POLBMAPTTHRB | |
| SCHEMBL29645741 | 0.91 | KDM4E (0.48) | KDM4EALDH1A1POLBMAPTTHRB | |
| SCHEMBL31149923 | 0.90 | KDM4E (0.43) | KDM4EALDH1A1POLBMAPTTHRB | |
| SCHEMBL29646008 | 0.90 | KDM4E (0.47) | KDM4EALDH1A1POLBMAPTTHRB | |
| SCHEMBL29645929 | 0.90 | KDM4E (0.47) | KDM4EALDH1A1POLBMAPTTHRB | |
| SCHEMBL29645699 | 0.90 | KDM4E (0.47) | KDM4EALDH1A1POLBMAPTTHRB | |
| SCHEMBL29645839 | 0.90 | KDM4E (0.47) | KDM4EALDH1A1POLBMAPTTHRB | |
| SCHEMBL29645416 | 0.90 | KDM4E (0.45) | KDM4EALDH1A1POLBMAPTTHRB | |
| SCHEMBL29645586 | 0.89 | KDM4E (0.48) | KDM4EALDH1A1POLBMAPTTHRB | |
| SCHEMBL29646501 | 0.89 | KDM4E (0.46) | KDM4EALDH1A1POLBMAPTTHRB |
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-114466850-A | [1,2,4] triazolo [1,5-C ] quinazolin-5-amines | 拜耳股份有限公司 | 2022-05-10 | — | — | CN | claimed |