Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 5/20 | 0.35 |
| ▸ | HRH2 | P25021 | 4/20 | 0.35 |
| ▸ | MEN1 | O00255 | 2/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.33 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.33 |
| ▸ | PDK3 | Q15120 | 1/20 | 0.33 |
| ▸ | PDK4 | Q16654 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.31 |
| ▸ | MAP3K12 | Q12852 | 1/20 | 0.31 |
| ▸ | KHK | P50053 | 1/20 | 0.30 |
| ▸ | ACHE | P22303 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL30015449 | 0.86 | HRH3 (0.39) | HRH3HRH2MEN1KMT2AALDH1A1 | |
| SCHEMBL24697557 | 0.86 | HRH3 (0.39) | HRH3HRH2MEN1KMT2AALDH1A1 | |
| SCHEMBL24697598 | 0.85 | ALDH1A1 (0.33) | HRH3HRH2ALDH1A1 | |
| SCHEMBL24698900 | 0.84 | MEN1 (0.46) | HRH3HRH2MEN1KMT2AALDH1A1 | |
| SCHEMBL24699438 | 0.84 | HRH3 (0.49) | HRH3HRH2MEN1KMT2AALDH1A1 | |
| SCHEMBL24698728 | 0.83 | KDM4E (0.36) | MEN1KMT2AALDH1A1KDM4ELMNA | |
| SCHEMBL24699012 | 0.83 | MTOR (0.41) | HRH3HRH2MEN1KMT2AALDH1A1 | |
| SCHEMBL30015464 | 0.83 | MTOR (0.41) | HRH3HRH2MEN1KMT2AALDH1A1 | |
| SCHEMBL24698168 | 0.83 | HRH2 (0.43) | HRH3HRH2MEN1KMT2AALDH1A1 | |
| SCHEMBL24698648 | 0.83 | HRH3 (0.36) | HRH3MEN1KMT2AALDH1A1PDK1 |
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-2022212194-A1 | KHK INHIBITORS | GILEAD SCIENCES, INC. (US) | 2022-10-06 | — | — | WO | disclosed |