Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM2 | P08172 | 1/20 | 0.36 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.36 |
| ▸ | THRA | P10827 | 1/20 | 0.35 |
| ▸ | THRB | P10828 | 1/20 | 0.35 |
| ▸ | ESR1 | P03372 | 2/20 | 0.34 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.34 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.34 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.33 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.33 |
| ▸ | CSF1R | P07333 | 2/20 | 0.33 |
| ▸ | EGFR | P00533 | 1/20 | 0.33 |
| ▸ | DRD3 | P35462 | 2/20 | 0.32 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.32 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.32 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.32 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.32 |
| ▸ | CA12 | O43570 | 1/20 | 0.32 |
| ▸ | CA1 | P00915 | 1/20 | 0.32 |
| ▸ | CA2 | P00918 | 1/20 | 0.32 |
| ▸ | CA4 | P22748 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL23058480 | 0.79 | AOC3 (0.38) | SLC6A2SLC6A3 | |
| SCHEMBL23058147 | 0.78 | THRA (0.33) | THRATHRBESR1ESR2ALOX5 | |
| SCHEMBL11141687 | 0.74 | ALOX5 (0.40) | ESR1ESR2ALOX5CSF1REGFR | |
| SCHEMBL23058486 | 0.72 | DAGLA (0.42) | HDAC1HDAC8HDAC6HRH3 | |
| SCHEMBL13784552 | 0.72 | ESR1 (0.44) | ESR1ESR2SLC6A2SLC6A3 | |
| SCHEMBL23059048 | 0.71 | PDPK1 (0.33) | DRD3 | |
| SCHEMBL23058487 | 0.71 | PDE2A (0.47) | SLC6A2SLC6A3HDAC1HDAC6 | |
| SCHEMBL16919625 | 0.70 | ESR1 (0.58) | ESR1ESR2SLC6A2SLC6A3HDAC8 | |
| SCHEMBL6447082 | 0.69 | CSF1R (0.40) | ALOX5CSF1REGFRHRH3 | |
| SCHEMBL12111408 | 0.69 | ESR1 (0.41) | ESR1ESR2SLC6A2SLC6A3HRH3 |
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-2021041588-A1 | SUBSTITUTED PYRIDOPYRIMIDINONYL COMPOUNDS USEFUL AS T CELL ACTIVATORS | BRISTOL-MYERS SQUIBB COMPANY (US) | 2021-03-04 | — | — | WO | disclosed |