Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD2 | P14416 | 4/20 | 0.43 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.43 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.42 |
| ▸ | IDO1 | P14902 | 1/20 | 0.42 |
| ▸ | EGFR | P00533 | 2/20 | 0.41 |
| ▸ | ERBB2 | P04626 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | PTGS1 | P23219 | 3/20 | 0.40 |
| ▸ | PTGS2 | P35354 | 3/20 | 0.40 |
| ▸ | HTR1A | P08908 | 2/20 | 0.39 |
| ▸ | MMP2 | P08253 | 3/20 | 0.39 |
| ▸ | MMP9 | P14780 | 3/20 | 0.39 |
| ▸ | KDM1A | O60341 | 1/20 | 0.38 |
| ▸ | HTR7 | P34969 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL7812867 | 0.77 | CHRNB2 (0.52) | DRD2SLC6A4EGFRERBB2 | |
| SCHEMBL27999351 | 0.76 | SLC6A4 (0.49) | DRD2SLC6A4MTNR1AEGFRERBB2 | |
| SCHEMBL7967161 | 0.72 | KDM4E (0.49) | MTNR1AIDO1KDM4EALDH1A1MAPT | |
| SCHEMBL27956975 | 0.70 | MTNR1A (0.55) | DRD2SLC6A4MTNR1AIDO1KDM4E | |
| SCHEMBL24780388 | 0.70 | KMT2A (0.41) | MTNR1AEGFRERBB2KDM4EMAPT | |
| SCHEMBL7255368 | 0.68 | CHRNB2 (0.44) | DRD2SLC6A4MTNR1AEGFRERBB2 | |
| SCHEMBL17996703 | 0.68 | MTNR1A (0.53) | DRD2SLC6A4MTNR1AIDO1KDM4E | |
| SCHEMBL562292 | 0.66 | MTNR1A (0.58) | DRD2SLC6A4MTNR1AIDO1KDM4E | |
| SCHEMBL19284721 | 0.66 | MTNR1A (0.54) | DRD2SLC6A4MTNR1AIDO1KDM4E | |
| SCHEMBL7562950 | 0.66 | HTR1A (0.61) | KDM4EALDH1A1MAPTHTR1AHTR7 |
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-113620863-B | Piperazine and piperidine derivatives, their synthesis and use | 内盖夫国家生物技术研究所 | 2024-04-05 | — | — | CN | disclosed |
| CN-113620863-A | Novel piperazine and piperidine derivatives, their synthesis and their use | 内盖夫国家生物技术研究所 | 2021-11-09 | — | — | CN | disclosed |
| CN-108290889-B | Novel piperazine and piperidine derivatives, their synthesis and their use in inhibiting VDAC oligomerization, apoptosis and mitochondrial dysfunction | 内盖夫国家生物技术研究所 | 2021-08-10 | — | — | CN | disclosed |