Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR3A | P46098 | 1/20 | 0.47 |
| ▸ | SLC6A3 | Q01959 | 3/20 | 0.43 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.42 |
| ▸ | POLB | P06746 | 2/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.42 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | SRD5A1 | P18405 | 1/20 | 0.40 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.39 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.37 |
| ▸ | MAP1LC3B | Q9GZQ8 | 1/20 | 0.36 |
| ▸ | DRD2 | P14416 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 3/20 | 0.35 |
| ▸ | HPGD | P15428 | 2/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL657357 | 0.77 | TSHR (0.57) | HTR3ASLC6A3SLC6A2ALDH1A1POLB | |
| SCHEMBL22831445 | 0.77 | TSHR (0.57) | HTR3ASLC6A3SLC6A2ALDH1A1POLB | |
| SCHEMBL560686 | 0.77 | TSHR (0.57) | HTR3ASLC6A3SLC6A2ALDH1A1POLB | |
| SCHEMBL9669985 | 0.76 | TSHR (0.55) | HTR3ASLC6A3SLC6A2ALDH1A1POLB | |
| SCHEMBL20177918 | 0.73 | HTR2C (0.40) | SLC6A3SLC6A2ALOX12SLC6A4GAA | |
| SCHEMBL10536088 | 0.72 | ESR2 (0.50) | HTR3ASLC6A3SLC6A2ALDH1A1POLB | |
| SCHEMBL10536101 | 0.72 | ESR2 (0.50) | HTR3ASLC6A3SLC6A2ALDH1A1POLB | |
| SCHEMBL28289382 | 0.70 | HTR3A (0.57) | HTR3ASLC6A3SLC6A2ALDH1A1POLB | |
| SCHEMBL6779675 | 0.70 | HTR3A (0.69) | HTR3ASLC6A3SLC6A2ALDH1A1POLB | |
| SCHEMBL6981637 | 0.69 | POLB (0.58) | HTR3ASLC6A3SLC6A2ALDH1A1POLB |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2018092916-A1 | NITROGEN-CONTAINING POLYCYCLIC HETEROCYCLIC DERIVATIVE | 宇部興産株式会社 | 2018-05-24 | — | — | WO | disclosed |