Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | GFER | P55789 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.37 |
| ▸ | OPRK1 | P41145 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.37 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.37 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 3/20 | 0.35 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.35 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.35 |
| ▸ | KARS1 | Q15046 | 2/20 | 0.33 |
| ▸ | RXRA | P19793 | 1/20 | 0.33 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.33 |
| ▸ | CDK2 | P24941 | 1/20 | 0.33 |
| ▸ | RXRB | P28702 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL25457843 | 0.80 | HRH3 (0.36) | OPRK1OPRM1OPRL1HRH3OPRD1 | |
| SCHEMBL25174304 | 0.79 | MEN1 (0.39) | HRH3MEN1KMT2A | |
| SCHEMBL30372231 | 0.79 | MEN1 (0.39) | HRH3MEN1KMT2A | |
| SCHEMBL26849180 | 0.78 | HPGD (0.44) | HPGDGFERHSD17B10NR1H3CYP3A4 | |
| SCHEMBL27445638 | 0.78 | OPRM1 (0.40) | HPGDGFERHSD17B10NR1H3CYP3A4 | |
| SCHEMBL25453061 | 0.77 | KDM4E (0.37) | OPRK1ALDH1A1OPRM1OPRL1HRH3 | |
| SCHEMBL29813861 | 0.76 | MEN1 (0.39) | HRH3MEN1KMT2A | |
| SCHEMBL27445582 | 0.75 | OPRM1 (0.41) | HPGDGFERHSD17B10NR1H3CYP3A4 | |
| SCHEMBL30564277 | 0.74 | HRH3 (0.52) | ALDH1A1OPRM1MAPTALOX15HRH3 | |
| SCHEMBL25452836 | 0.73 | METAP1 (0.38) | CYP3A4HRH3MAOAMAOB |
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-2024119122-A1 | CDK INHIBITORS AND METHODS AND USE THEREOF | RELAY THERAPEUTICS, INC. (US) | 2024-06-06 | — | — | WO | disclosed |