Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RET | P07949 | 4/20 | 0.42 |
| ▸ | SRC | P12931 | 3/20 | 0.40 |
| ▸ | PDGFRA | P16234 | 2/20 | 0.40 |
| ▸ | CDK5 | Q00535 | 2/20 | 0.40 |
| ▸ | KDR | P35968 | 2/20 | 0.40 |
| ▸ | DAPK3 | O43293 | 1/20 | 0.40 |
| ▸ | RIPK2 | O43353 | 1/20 | 0.40 |
| ▸ | ABL1 | P00519 | 1/20 | 0.40 |
| ▸ | EGFR | P00533 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | LCK | P06239 | 1/20 | 0.40 |
| ▸ | FYN | P06241 | 1/20 | 0.40 |
| ▸ | YES1 | P07947 | 1/20 | 0.40 |
| ▸ | LYN | P07948 | 1/20 | 0.40 |
| ▸ | HCK | P08631 | 1/20 | 0.40 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.40 |
| ▸ | FGR | P09769 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | PRKACA | P17612 | 1/20 | 0.40 |
| ▸ | EPHB2 | P29323 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL25696301 | 0.81 | RET (0.39) | RETSRCPDGFRACDK5KDR | |
| SCHEMBL17108567 | 0.78 | ADORA3 (0.39) | MAT2AADORA2AADORA3 | |
| SCHEMBL10320957 | 0.77 | NR4A2 (0.42) | KDRCYP2C9SMN1; SMN2NR4A2KMO | |
| SCHEMBL4420492 | 0.75 | PRKD3 (0.43) | RETSRCKDRRIPK2ABL1 | |
| SCHEMBL6480204 | 0.71 | PDGFRA (0.46) | PDGFRACDK5PRKACAMAPK8TYRO3 | |
| SCHEMBL11751308 | 0.69 | ADORA2A (0.49) | PDGFRACDK5CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL11749575 | 0.68 | PDGFRA (0.49) | PDGFRACDK5SMN1; SMN2TYRO3KMO | |
| SCHEMBL11751709 | 0.68 | PDGFRA (0.49) | PDGFRACDK5ABL1SMN1; SMN2NR4A2 | |
| SCHEMBL11750409 | 0.68 | PDGFRA (0.49) | PDGFRACDK5ABL1SMN1; SMN2TYRO3 | |
| SCHEMBL13106495 | 0.67 | MAPK8 (0.41) | MAPK8MAPK9MAPK10SMN1; SMN2CLK4 |
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 |