Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH2 | P25021 | 1/20 | 0.36 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.36 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.32 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.31 |
| ▸ | HTR2A | P28223 | 1/20 | 0.31 |
| ▸ | HTR2C | P28335 | 1/20 | 0.31 |
| ▸ | HTR2B | P41595 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.30 |
| ▸ | PIK3R1 | P27986 | 1/20 | 0.30 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.30 |
| ▸ | CDK9 | P50750 | 1/20 | 0.30 |
| ▸ | USP2 | O75604 | 1/20 | 0.30 |
| ▸ | HPGD | P15428 | 1/20 | 0.30 |
| ▸ | TSHR | P16473 | 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 | |
|---|---|---|---|---|
| SCHEMBL24698113 | 0.88 | HRH2 (0.36) | HRH2HRH3HCRTR1HCRTR2ALDH1A1 | |
| SCHEMBL24698951 | 0.86 | HCRTR1 (0.34) | HCRTR1HCRTR2ALDH1A1SMN1; SMN2HSD17B10 | |
| SCHEMBL24698106 | 0.85 | HRH2 (0.39) | HRH2HRH3ALDH1A1HTR2CSMN1; SMN2 | |
| SCHEMBL24697738 | 0.83 | HRH2 (0.38) | HRH2HRH3HCRTR1HCRTR2ALDH1A1 | |
| SCHEMBL24698191 | 0.81 | HCRTR1 (0.36) | HRH2HRH3HCRTR1HCRTR2ALDH1A1 | |
| SCHEMBL24698174 | 0.75 | CFD (0.35) | HCRTR1HCRTR2CDK9 | |
| SCHEMBL24698190 | 0.73 | KDM4E (0.42) | HRH2HRH3ALDH1A1HTR2CSMN1; SMN2 | |
| SCHEMBL24697552 | 0.72 | SPR (0.37) | HCRTR1HCRTR2ALDH1A1HSD17B10KDM4E | |
| SCHEMBL24699432 | 0.71 | HRH2 (0.38) | HRH2HRH3HCRTR1HCRTR2ALDH1A1 | |
| SCHEMBL24698728 | 0.71 | KDM4E (0.36) | ALDH1A1SMN1; SMN2HSD17B10KDM4EPIK3CA |
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 |