Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 7/20 | 0.41 |
| ▸ | SRD5A2 | P31213 | 5/20 | 0.41 |
| ▸ | HPGD | P15428 | 4/20 | 0.41 |
| ▸ | MAPT | P10636 | 3/20 | 0.41 |
| ▸ | HTT | P42858 | 2/20 | 0.41 |
| ▸ | ESR1 | P03372 | 1/20 | 0.41 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.41 |
| ▸ | PKM | P14618 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.39 |
| ▸ | ALPG | P10696 | 2/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.35 |
| ▸ | USP2 | O75604 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.34 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.34 |
| ▸ | GSK3B | P49841 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL9203574 | 0.85 | TSHR (0.50) | SRD5A2ALDH1A1SMN1; SMN2 | |
| SCHEMBL9213640 | 0.83 | ALDH1A1 (0.38) | ESR1MEN1KMT2AALDH1A1PTPN1 | |
| SCHEMBL7640651 | 0.81 | LMNA (0.31) | LMNAMAPTESR1 | |
| SCHEMBL10894813 | 0.77 | LMNA (0.48) | LMNASRD5A2HPGDMAPTHTT | |
| SCHEMBL28095147 | 0.75 | ALDH1A1 (0.53) | LMNASRD5A2HPGDMAPTHTT | |
| SCHEMBL27278446 | 0.75 | LMNA (0.50) | LMNAMAPTESR1PKMMEN1 | |
| SCHEMBL10915629 | 0.75 | ESR1 (0.50) | LMNAHPGDMAPTESR1ESR2 | |
| SCHEMBL7995537 | 0.74 | SRD5A2 (0.48) | SRD5A2HPGDHTTMEN1KMT2A | |
| SCHEMBL28795633 | 0.72 | CYP2A6 (0.42) | ALDH1A1MAPK1GSK3B | |
| SCHEMBL9370511 | 0.70 | TSHR (0.42) | LMNAHPGDMEN1KMT2AMAPK1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-102149280-B | Deuterated benzylbenzene derivatives and methods of use thereof | 泰拉科斯有限公司 | 2017-05-24 | — | — | CN | disclosed |