Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCG2 | Q9UNQ0 | 11/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.47 |
| ▸ | GAA | P10253 | 2/20 | 0.47 |
| ▸ | KCNA3 | P22001 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.45 |
| ▸ | PPARG | P37231 | 1/20 | 0.44 |
| ▸ | ABCB1 | P08183 | 4/20 | 0.44 |
| ▸ | ABCC1 | P33527 | 3/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | ATM | Q13315 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL21647150 | 0.88 | ABCG2 (0.52) | ABCG2KDM4EALDH1A1GAAKCNA3 | |
| SCHEMBL21647141 | 0.83 | ABCG2 (0.47) | ABCG2KDM4EALDH1A1GAAKCNA3 | |
| SCHEMBL972002 | 0.80 | KDM4E (0.68) | ABCG2KDM4EALDH1A1GAAKCNA3 | |
| SCHEMBL15231797 | 0.78 | KDM4E (0.62) | ABCG2KDM4EALDH1A1GAAKCNA3 | |
| SCHEMBL28565701 | 0.78 | ABCG2 (0.69) | ABCG2KDM4EALDH1A1GAAKCNA3 | |
| SCHEMBL21647139 | 0.77 | ABCG2 (0.61) | ABCG2KDM4EALDH1A1GAAKCNA3 | |
| SCHEMBL30558216 | 0.77 | ABCG2 (0.59) | ABCG2KDM4EALDH1A1GAAKCNA3 | |
| SCHEMBL29080561 | 0.77 | ABCG2 (0.59) | ABCG2KDM4EALDH1A1GAAKCNA3 | |
| SCHEMBL29080531 | 0.74 | ABCG2 (0.56) | ABCG2KDM4EALDH1A1GAAKCNA3 | |
| SCHEMBL30558208 | 0.74 | ABCG2 (0.56) | ABCG2KDM4EALDH1A1GAAKCNA3 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-110790739-B | Compounds for treating neurological diseases and uses thereof | 陕西麦科奥特科技有限公司 | 2021-10-01 | — | — | CN | disclosed |
| CN-110790739-A | Compounds for treating neurological diseases and uses thereof | 陕西麦科奥特科技有限公司 | 2020-02-14 | — | — | CN | disclosed |
| WO-2020024977-A1 | COMPOUND FOR TREATING NERVOUS SYSTEM DISEASES AND USE THEREOF | 陕西麦科奥特科技有限公司 | 2020-02-06 | — | — | WO | disclosed |