Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1B | P28222 | 8/20 | 0.46 |
| ▸ | HTR1D | P28221 | 5/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.46 |
| ▸ | PKM | P14618 | 1/20 | 0.46 |
| ▸ | HTR6 | P50406 | 7/20 | 0.42 |
| ▸ | HTR1A | P08908 | 3/20 | 0.42 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.42 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.42 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.42 |
| ▸ | DRD1 | P21728 | 1/20 | 0.42 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.42 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.42 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.42 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL28319005 | 1.00 | HTR1B (0.46) | HTR1BHTR1DPOLBPKMHTR6 | |
| SCHEMBL6740739 | 0.81 | HTR1B (0.51) | HTR1BHTR1DHTR6HTR1A | |
| Ammonia Solution, Strong SCHEMBL29771408 | 0.73 | HTR1D (0.49) | HTR1BHTR1DHTR6 | |
| SCHEMBL4553595 | 0.73 | RAD52 (0.44) | POLBPKMHRH3 | |
| SCHEMBL11378891 | 0.72 | ADRA1D (0.68) | HTR1BHTR1DHTR6 | |
| SCHEMBL4553364 | 0.71 | IDH1 (0.44) | POLBPKM | |
| SCHEMBL6948541 | 0.71 | HTR6 (0.44) | HTR1BHTR1DHTR6HTR1A | |
| SCHEMBL6948549 | 0.71 | HTR6 (0.44) | HTR1BHTR1DHTR6HTR1A | |
| SCHEMBL13162975 | 0.70 | HTR1D (0.52) | HTR1BHTR1DHTR6HRH3 | |
| SCHEMBL764285 | 0.70 | DAO (0.60) | POLB |
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-110256421-A | KRAS-G12C inhibitor | 微境生物医药科技(上海)有限公司 | 2019-09-20 | — | — | CN | disclosed |