Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | GLA | P06280 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | CASP1 | P29466 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | CASP7 | P55210 | 1/20 | 0.37 |
| ▸ | ATM | Q13315 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
| ▸ | ELANE | P08246 | 1/20 | 0.36 |
| ▸ | MTOR | P42345 | 1/20 | 0.36 |
| ▸ | HTR3A | P46098 | 1/20 | 0.36 |
| ▸ | PRMT5 | O14744 | 1/20 | 0.35 |
| ▸ | WDR77 | Q9BQA1 | 1/20 | 0.35 |
| ▸ | RAD52 | P43351 | 1/20 | 0.35 |
| ▸ | SLC16A3 | O15427 | 1/20 | 0.35 |
| ▸ | SLC16A1 | P53985 | 1/20 | 0.35 |
| ▸ | NPBWR1 | P48145 | 4/20 | 0.34 |
| ▸ | MCHR1 | Q99705 | 3/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL23341423 | 0.78 | MEN1 (0.38) | KDM4EALDH1A1GLAGAAHPGD | |
| SCHEMBL23735733 | 0.77 | TUBB4A (0.35) | KDM4EALDH1A1GLAGAAHPGD | |
| SCHEMBL19790258 | 0.77 | ELANE (0.35) | GLAHPGDHTTELANEMAPK1 | |
| SCHEMBL25696303 | 0.74 | CA1 (0.44) | KDM4EALDH1A1GLAGAAHPGD | |
| SCHEMBL20315039 | 0.74 | CRHR1 (0.39) | KDM4EALDH1A1GLAGAAHPGD | |
| SCHEMBL24992571 | 0.74 | MAPK1 (0.39) | KDM4EHPGDHTTPRMT5WDR77 | |
| SCHEMBL27137437 | 0.74 | MAPK1 (0.42) | KDM4EALDH1A1HTTMAPK1CYP19A1 | |
| SCHEMBL20757767 | 0.69 | TRPC5 (0.42) | KDM4EALDH1A1GLAGAAHPGD | |
| SCHEMBL29702376 | 0.68 | KAT2B (0.43) | KDM4EALDH1A1HPGD | |
| SCHEMBL10477357 | 0.67 | ALDH1A1 (0.46) | KDM4EALDH1A1HSD17B10ELANEKCNH2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3558955-B1 | BENZISOTHIAZOLE, ISOTHIAZOLO[3,4-B]PYRIDINE, QUINAZOLINE, PHTHALAZINE, PYRIDO[2,3-D]PYRIDAZINE AND PYRIDO[2,3-D]PYRIMIDINE DERIVATIVES AS KRAS G12C INHIBITORS FOR TREATING LUNG, PANCREATIC OR COLORECTAL CANCER | AMGEN INC (US) | 2021-08-11 | — | — | EP | disclosed |