Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR4A2 | P43354 | 3/20 | 0.50 |
| ▸ | CFTR | P13569 | 1/20 | 0.49 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.49 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.49 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.49 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.48 |
| ▸ | EDNRA | P25101 | 1/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 2/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.45 |
| ▸ | HPGD | P15428 | 1/20 | 0.45 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.45 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.45 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.45 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.45 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL24951908 | 0.85 | NPC1 (0.56) | ALDH1A1MAPK1LMNASMN1; SMN2HPGD | |
| SCHEMBL29742813 | 0.85 | NPC1 (0.56) | ALDH1A1MAPK1LMNASMN1; SMN2HPGD | |
| SCHEMBL29742828 | 0.83 | MKNK1 (0.45) | ALDH1A1LMNAMAPTHPGDKMT2A | |
| SCHEMBL24951909 | 0.83 | MKNK1 (0.45) | ALDH1A1LMNAMAPTHPGDKMT2A | |
| SCHEMBL2665747 | 0.83 | ALDH1A1 (0.61) | ALDH1A1MAPK1LMNASMN1; SMN2MAPT | |
| SCHEMBL12876531 | 0.79 | ALDH1A1 (0.48) | ALDH1A1EDNRAMAPK1LMNASMN1; SMN2 | |
| SCHEMBL3101392 | 0.77 | HDAC6 (0.52) | ALDH1A1MAPK1SMN1; SMN2MAPTHPGD | |
| SCHEMBL4184070 | 0.77 | ALDH1A1 (0.44) | ALDH1A1EDNRAMAPK1LMNASMN1; SMN2 | |
| SCHEMBL3107571 | 0.77 | NPC1 (0.44) | ALDH1A1EDNRAMAPK1SMN1; SMN2MAPT | |
| SCHEMBL17212160 | 0.77 | ALDH1A1 (0.53) | NR4A2CYP19A1CYP11B1CYP11B2ALDH1A1 |
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-113444081-B | Thiadiazole carboxamide compounds and application thereof | 浙江大学 | 2022-07-05 | — | — | CN | disclosed |
| CN-113444081-A | Thiadiazole amide compound and application thereof | 浙江大学 | 2021-09-28 | — | — | CN | disclosed |