Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | RPS6KA5 | O75582 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL28022074 | 0.86 | ALDH1A1 (0.43) | ALDH1A1KDM4EMAPT | |
| SCHEMBL51486 | 0.82 | EGFR (0.52) | EGFRALDH1A1RPS6KA5KDM4EMAPT | |
| SCHEMBL29367065 | 0.82 | EGFR (0.52) | EGFRALDH1A1RPS6KA5KDM4EMAPT | |
| SCHEMBL28742280 | 0.82 | EGFR (0.52) | EGFRALDH1A1RPS6KA5KDM4EMAPT | |
| Quinazoline SCHEMBL6372936 | 0.81 | EGFR (0.65) | EGFRALDH1A1 | |
| SCHEMBL29188217 | 0.80 | EGFR (0.50) | EGFRALDH1A1RPS6KA5KDM4EMAPT | |
| Hydrochloric Acid SCHEMBL30980980 | 0.80 | EGFR (0.50) | EGFRALDH1A1RPS6KA5KDM4EMAPT | |
| Hydrochloric Acid SCHEMBL22289522 | 0.80 | EGFR (0.50) | EGFRALDH1A1RPS6KA5KDM4EMAPT | |
| Pyrrole SCHEMBL82535 | 0.80 | EGFR (0.42) | EGFRALDH1A1RPS6KA5KDM4EMAPT | |
| Quinoxaline SCHEMBL3988599 | 0.79 | ALDH1A1 (0.38) | ALDH1A1KDM4EMAPT |
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-105418638-B | With terminal alkyne, two bromoalkanes, CO2The method that thick triazole compound is synthesized with sodium azide | 广西师范大学 | 2018-01-19 | — | — | CN | disclosed |
| CN-105418638-A | Method for synthesizing condensed triazole compound with terminal alkyne, dibromo alkane, CO2 and sodium azide | UNIV GUANGXI NORMAL | 2016-03-23 | — | — | CN | disclosed |