Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 3/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.45 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.45 |
| ▸ | HTR2A | P28223 | 1/20 | 0.45 |
| ▸ | SCN1A | P35498 | 1/20 | 0.45 |
| ▸ | HTR2B | P41595 | 1/20 | 0.45 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.45 |
| ▸ | SCN2A | Q99250 | 1/20 | 0.45 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.45 |
| ▸ | SCN3A | Q9NY46 | 1/20 | 0.45 |
| ▸ | USP2 | O75604 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | TLR7 | Q9NYK1 | 4/20 | 0.40 |
| ▸ | TSHR | P16473 | 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 | |
|---|---|---|---|---|
| SCHEMBL19636917 | 0.88 | HRH3 (0.42) | HRH3ALDH1A1KCNH2SIGMAR1 | |
| SCHEMBL19637387 | 0.75 | HTR2A (0.43) | HRH3MAPK1ALDH1A1CYP1A2CHRM2 | |
| SCHEMBL22994841 | 0.74 | KDM4E (0.38) | HRH3ALDH1A1CYP1A2CYP2D6CYP3A4 | |
| SCHEMBL21895740 | 0.73 | ALDH1A1 (0.41) | HRH3MAPK1ALDH1A1CYP1A2CHRM2 | |
| SCHEMBL19637369 | 0.73 | HTT (0.35) | CYP1A2HTT | |
| SCHEMBL22994789 | 0.72 | KRAS (0.44) | HRH3MAPK1ALDH1A1CYP1A2CHRM2 | |
| SCHEMBL1603001 | 0.68 | NPC1 (0.44) | ALDH1A1KCNH2SIGMAR1TSHRKDM4E | |
| SCHEMBL22994702 | 0.67 | ALDH1A1 (0.41) | HRH3MAPK1ALDH1A1CYP1A2CHRM2 | |
| SCHEMBL21895570 | 0.67 | MAPK1 (0.41) | HRH3MAPK1ALDH1A1CYP1A2CHRM2 | |
| SCHEMBL13937523 | 0.65 | CYP2D6 (0.53) | HRH3MAPK1ALDH1A1CYP1A2CHRM2 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3710439-B1 | KRAS G12C INHIBITORS | MIRATI THERAPEUTICS INC (US) | 2023-02-15 | — | — | EP | disclosed |
| EP-3458445-B1 | KRAS G12C INHIBITORS | MIRATI THERAPEUTICS INC (US) | 2021-02-17 | — | — | EP | disclosed |
| WO-2020055755-A1 | COMBINATION THERAPIES | Mirati Therapeutics, Inc. (US) | 2020-03-19 | — | — | WO | disclosed |
| WO-2017201161-A1 | KRAS G12C INHIBITORS | Mirati Therapeutics, Inc. (US) | 2017-11-23 | — | — | WO | disclosed |