Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCN1 | O60741 | 1/20 | 0.36 |
| ▸ | HCN4 | Q9Y3Q4 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.35 |
| ▸ | PSEN1 | P49768 | 1/20 | 0.34 |
| ▸ | PSEN2 | P49810 | 1/20 | 0.34 |
| ▸ | APH1B | Q8WW43 | 1/20 | 0.34 |
| ▸ | NCSTN | Q92542 | 1/20 | 0.34 |
| ▸ | APH1A | Q96BI3 | 1/20 | 0.34 |
| ▸ | PSENEN | Q9NZ42 | 1/20 | 0.34 |
| ▸ | HTR1A | P08908 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.33 |
| ▸ | ATM | Q13315 | 1/20 | 0.33 |
| ▸ | LIPE | Q05469 | 1/20 | 0.33 |
| ▸ | HTR2A | P28223 | 1/20 | 0.33 |
| ▸ | HTR2C | P28335 | 1/20 | 0.33 |
| ▸ | HRH1 | P35367 | 1/20 | 0.33 |
| ▸ | HTR2B | P41595 | 1/20 | 0.33 |
| ▸ | HSD11B1 | P28845 | 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 | |
|---|---|---|---|---|
| SCHEMBL29423697 | 1.00 | HCN1 (0.36) | HCN1HCN4ALDH1A1SIGMAR1PSEN1 | |
| SCHEMBL29423684 | 0.88 | HTR1A (0.35) | HCN1HCN4SIGMAR1HTR1ASMN1; SMN2 | |
| SCHEMBL22692100 | 0.83 | SIGMAR1 (0.40) | ALDH1A1SIGMAR1ATMHTR2AHTR2C | |
| SCHEMBL23385946 | 0.82 | CYP1A2 (0.36) | ALDH1A1HTR1ASMN1; SMN2ATMHTR2A | |
| SCHEMBL29656734 | 0.82 | CYP1A2 (0.36) | ALDH1A1HTR1ASMN1; SMN2ATMHTR2A | |
| SCHEMBL30015560 | 0.78 | CYP1A2 (0.34) | ALDH1A1PSEN1PSEN2APH1BNCSTN | |
| SCHEMBL24483075 | 0.78 | HTR2A (0.41) | SIGMAR1PSEN1PSEN2APH1BNCSTN | |
| SCHEMBL31756478 | 0.74 | KDM4E (0.33) | ALDH1A1PSEN1PSEN2APH1BNCSTN | |
| SCHEMBL22692006 | 0.74 | SIGMAR1 (0.40) | ALDH1A1SIGMAR1ATMHTR2AHTR2C | |
| SCHEMBL24483739 | 0.73 | KDM1A (0.41) | SIGMAR1HTR2AHTR2CHRH1HTR2B |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2022115439-A1 | KRAS G12C INHIBITORS AND USES THEREOF | CALIFORNIA INSTITUTE OF TECHNOLOGY (US) | 2022-06-02 | — | — | WO | disclosed |
| WO-2020236940-A1 | KRAS G12C INHIBITORS AND USES THEREOF | CALIFORNIA INSTITUTE OF TECHNOLOGY (US) | 2020-11-26 | — | — | WO | disclosed |