Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MMP13 | P45452 | 2/20 | 0.46 |
| ▸ | LEF1 | Q9UJU2 | 1/20 | 0.44 |
| ▸ | F11 | P03951 | 2/20 | 0.43 |
| ▸ | MMP2 | P08253 | 1/20 | 0.40 |
| ▸ | PYGL | P06737 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | MAPT | P10636 | 4/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | XDH | P47989 | 1/20 | 0.38 |
| ▸ | NPY5R | Q15761 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.37 |
| ▸ | NPC1 | O15118 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | USP2 | O75604 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | TP53 | P04637 | 2/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | MAOA | P21397 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL24988007 | 0.87 | ALDH1A1 (0.49) | MMP13LEF1F11MMP2MAPT | |
| SCHEMBL28941288 | 0.77 | MMP13 (0.62) | MMP13MMP2MEN1KMT2AMAPT | |
| SCHEMBL23486667 | 0.75 | MMP13 (0.51) | MMP13LEF1F11MMP2KMT2A | |
| SCHEMBL29121378 | 0.74 | MMP13 (0.49) | MMP13LEF1MMP2MEN1KMT2A | |
| SCHEMBL28555873 | 0.73 | MMP13 (0.47) | MMP13LEF1F11MMP2PYGL | |
| SCHEMBL28555872 | 0.73 | MMP13 (0.47) | MMP13LEF1F11MMP2PYGL | |
| SCHEMBL3497422 | 0.72 | EGFR (0.57) | MMP13LEF1F11KMT2AKDM4E | |
| SCHEMBL5087408 | 0.72 | LEF1 (0.59) | MMP13LEF1PYGLMEN1KMT2A | |
| SCHEMBL6617416 | 0.72 | LEF1 (0.74) | MMP13LEF1F11MMP2KMT2A | |
| SCHEMBL7833243 | 0.71 | LEF1 (0.55) | MMP13LEF1MMP2MEN1KMT2A |
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-112608303-B | Piperazine intermediate, preparation method and application thereof | 华南理工大学 | 2021-10-26 | — | — | CN | disclosed |
| CN-112608303-A | Piperazine intermediate, preparation method and application thereof | 华南理工大学 | 2021-04-06 | — | — | CN | disclosed |