Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 3/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.42 |
| ▸ | PTGDR | Q13258 | 1/20 | 0.42 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.42 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.41 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.41 |
| ▸ | TAS1R2 | Q8TE23 | 1/20 | 0.41 |
| ▸ | SIRT1 | Q96EB6 | 4/20 | 0.41 |
| ▸ | ACHE | P22303 | 1/20 | 0.40 |
| ▸ | SIRT2 | Q8IXJ6 | 2/20 | 0.40 |
| ▸ | SIRT3 | Q9NTG7 | 2/20 | 0.40 |
| ▸ | HTR2A | P28223 | 3/20 | 0.39 |
| ▸ | HTR2C | P28335 | 3/20 | 0.39 |
| ▸ | HTR2B | P41595 | 3/20 | 0.39 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.39 |
| ▸ | HTR1A | P08908 | 1/20 | 0.39 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL24542973 | 1.00 | LMNA (0.43) | LMNAMEN1MAPTKMT2AKDM4C | |
| SCHEMBL19469643 | 0.91 | HTR2B (0.41) | PTGDRPTGDR2HTR2AHTR2CHTR2B | |
| SCHEMBL24542982 | 0.89 | KDM4C (0.42) | LMNAMEN1MAPTKMT2AKDM4C | |
| SCHEMBL22652430 | 0.83 | KMT2A (0.41) | LMNAMEN1MAPTKMT2AACHE | |
| SCHEMBL5847603 | 0.83 | MTNR1A (0.54) | — | |
| SCHEMBL28766567 | 0.82 | KDM4C (0.46) | KDM4CPTGDRPTGDR2TAS1R3TAS1R1 | |
| SCHEMBL29673179 | 0.82 | KDM4C (0.46) | KDM4CPTGDRPTGDR2TAS1R3TAS1R1 | |
| SCHEMBL1061933 | 0.81 | SIRT1 (0.54) | MEN1MAPTKMT2AKDM4CTAS1R3 | |
| SCHEMBL29552779 | 0.79 | P2RX7 (0.46) | HTR2AHTR2CHTR2B | |
| SCHEMBL23670494 | 0.79 | P2RX7 (0.46) | HTR2AHTR2CHTR2B |
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-114644631-A | KRAS G12C protein mutation inhibitor, preparation method thereof, pharmaceutical composition and application thereof | 上海维申医药有限公司 | 2022-06-21 | — | — | CN | disclosed |