Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALPL | P05186 | 4/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.45 |
| ▸ | HCAR3 | P49019 | 3/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | CA9 | Q16790 | 3/20 | 0.43 |
| ▸ | CA12 | O43570 | 2/20 | 0.43 |
| ▸ | CA1 | P00915 | 1/20 | 0.43 |
| ▸ | CA2 | P00918 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | HPGDS | O60760 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | THRB | P10828 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 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 | |
|---|---|---|---|---|
| SCHEMBL20455653 | 0.84 | HCAR3 (0.45) | ALPLHCAR3SMN1; SMN2KDM4EALDH1A1 | |
| SCHEMBL8720083 | 0.82 | SMN1; SMN2 (0.51) | LMNASMN1; SMN2KDM4EALDH1A1CA9 | |
| SCHEMBL7860349 | 0.81 | SMN1; SMN2 (0.46) | LMNASMN1; SMN2KDM4EALDH1A1CA9 | |
| SCHEMBL28575636 | 0.79 | SMN1; SMN2 (0.45) | LMNASMN1; SMN2KDM4EALDH1A1CA9 | |
| SCHEMBL1431995 | 0.78 | ALPL (0.54) | ALPLHCAR3CA9CA12ALOX15 | |
| SCHEMBL5327425 | 0.77 | LMNA (0.56) | LMNASMN1; SMN2KDM4EALDH1A1MEN1 | |
| SCHEMBL5599241 | 0.75 | HCAR3 (0.47) | ALPLHCAR3CA9CA12 | |
| SCHEMBL1092 | 0.75 | HCAR3 (0.54) | ALPLHCAR3KDM4ECA9CA12 | |
| SCHEMBL31136151 | 0.74 | MAPK1 (0.53) | ALPLHCAR3CA9CA12KMT2A | |
| SCHEMBL5599286 | 0.74 | HCAR3 (0.46) | ALPLHCAR3CA9CA12 |
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-2021215545-A1 | ANTICANCER COMBINATION THERAPY WITH N-(1-ACRYLOYL-AZETIDIN-3-YL)-2-((1H-INDAZOL-3-YL)AMINO)METHYL)-1H-IMIDAZOLE-5-CARBOXAMIDE INHIBITOR OF KRAS-G12C | TAIHO PHARMACEUTICAL CO., LTD. (JP) | 2021-10-28 | — | — | WO | disclosed |