Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.48 |
| ▸ | MAPT | P10636 | 3/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.40 |
| ▸ | CA12 | O43570 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
| ▸ | CA7 | P43166 | 1/20 | 0.39 |
| ▸ | CA9 | Q16790 | 1/20 | 0.39 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.37 |
| ▸ | TTR | P02766 | 1/20 | 0.36 |
| ▸ | DPP4 | P27487 | 1/20 | 0.36 |
| ▸ | ATM | Q13315 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 2/20 | 0.34 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | AHCY | P23526 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 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 | |
|---|---|---|---|---|
| SCHEMBL7023950 | 0.79 | HCAR2 (0.47) | HCAR2MAPTL3MBTL1CA12CA1 | |
| SCHEMBL8242959 | 0.79 | HCAR2 (0.47) | HCAR2MAPTL3MBTL1CA12CA1 | |
| SCHEMBL6854411 | 0.78 | HCAR2 (0.46) | HCAR2MAPTL3MBTL1CA12CA1 | |
| SCHEMBL17679763 | 0.76 | L3MBTL1 (0.38) | HCAR2MAPTL3MBTL1CA12CA1 | |
| Diethyl Maleate SCHEMBL2015895 | 0.73 | HCAR2 (0.80) | HCAR2MAPTCA12CA1CA2 | |
| Diethyl Maleate SCHEMBL42602 | 0.73 | HCAR2 (0.80) | HCAR2MAPTCA12CA1CA2 | |
| Diethyl Maleate SCHEMBL2015896 | 0.73 | HCAR2 (0.80) | HCAR2MAPTCA12CA1CA2 | |
| Diethyl Maleate SCHEMBL27966383 | 0.73 | HCAR2 (0.80) | HCAR2MAPTCA12CA1CA2 | |
| Diethyl Maleate SCHEMBL60423 | 0.73 | HCAR2 (0.80) | HCAR2MAPTCA12CA1CA2 | |
| Diethyl Maleate SCHEMBL43033 | 0.73 | HCAR2 (0.80) | HCAR2MAPTCA12CA1CA2 |
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-2017201161-A1 | KRAS G12C INHIBITORS | Mirati Therapeutics, Inc. (US) | 2017-11-23 | — | — | WO | disclosed |