Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 1/20 | 0.43 |
| ▸ | CA1 | P00915 | 1/20 | 0.43 |
| ▸ | CA7 | P43166 | 1/20 | 0.43 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.41 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.41 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.41 |
| ▸ | MMP1 | P03956 | 2/20 | 0.39 |
| ▸ | MMP9 | P14780 | 2/20 | 0.39 |
| ▸ | MMP13 | P45452 | 2/20 | 0.39 |
| ▸ | PTPN2 | P17706 | 1/20 | 0.39 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.39 |
| ▸ | PTPRA | P18433 | 1/20 | 0.39 |
| ▸ | PTPRB | P23467 | 1/20 | 0.39 |
| ▸ | MMP8 | P22894 | 1/20 | 0.38 |
| ▸ | STS | P08842 | 1/20 | 0.38 |
| ▸ | AKT1 | P31749 | 3/20 | 0.37 |
| ▸ | RECQL | P46063 | 2/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL17844787 | 0.84 | PTPRC (0.42) | CA12CA1CA7CA14MMP1 | |
| SCHEMBL17844873 | 0.83 | GRM2 (0.40) | CA12CA1CA7CA14MMP1 | |
| SCHEMBL8287363 | 0.77 | SMN1; SMN2 (0.50) | CA12CA1CA7CA14SMN1; SMN2 | |
| SCHEMBL7034400 | 0.76 | DGAT1 (0.34) | CA12CA1CA7CA14 | |
| SCHEMBL971950 | 0.76 | SLC6A2 (0.52) | CA1SMN1; SMN2HIF1ASLC6A2TAAR1 | |
| SCHEMBL6464407 | 0.75 | SMN1; SMN2 (0.66) | CA12CA1CA7CA14SMN1; SMN2 | |
| SCHEMBL4937591 | 0.75 | SMN1; SMN2 (0.66) | CA12CA1CA7CA14SMN1; SMN2 | |
| SCHEMBL27889856 | 0.74 | SMN1; SMN2 (0.55) | CA12CA1CA7CA14SMN1; SMN2 | |
| SCHEMBL7091384 | 0.74 | MMP8 (0.46) | CA12CA1CA7CA14SMN1; SMN2 | |
| SCHEMBL28841486 | 0.74 | MMP8 (0.54) | CA12CA1CA7CA14SMN1; SMN2 |
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-2016095088-A1 | ERK INHIBITORS | MERCK SHARP & DOHME CORP. (US) | 2016-06-23 | — | — | WO | disclosed |