Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 4/20 | 0.54 |
| ▸ | CA12 | O43570 | 2/20 | 0.54 |
| ▸ | CA9 | Q16790 | 2/20 | 0.54 |
| ▸ | NFKBIA | P25963 | 1/20 | 0.52 |
| ▸ | RELA | Q04206 | 1/20 | 0.52 |
| ▸ | CA1 | P00915 | 3/20 | 0.48 |
| ▸ | MMP1 | P03956 | 1/20 | 0.47 |
| ▸ | MMP2 | P08253 | 1/20 | 0.47 |
| ▸ | MMP9 | P14780 | 1/20 | 0.47 |
| ▸ | MMP8 | P22894 | 1/20 | 0.47 |
| ▸ | MMP13 | P45452 | 1/20 | 0.47 |
| ▸ | CA3 | P07451 | 1/20 | 0.47 |
| ▸ | CA4 | P22748 | 1/20 | 0.47 |
| ▸ | CA6 | P23280 | 1/20 | 0.47 |
| ▸ | CA5A | P35218 | 1/20 | 0.47 |
| ▸ | CA7 | P43166 | 1/20 | 0.47 |
| ▸ | CA13 | Q8N1Q1 | 1/20 | 0.47 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.47 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL848502 | 0.82 | KEAP1 (0.48) | NFKBIAMMP2KMT2AMEN1SMN1; SMN2 | |
| SCHEMBL29440555 | 0.74 | AURKA (0.63) | CA2CA12CA9NFKBIARELA | |
| SCHEMBL2734370 | 0.72 | CA2 (0.68) | CA2CA12CA9CA1KMT2A | |
| SCHEMBL7498033 | 0.71 | CA2 (0.83) | CA2CA12CA9CA1MMP1 | |
| SCHEMBL2407197 | 0.71 | L3MBTL1 (0.66) | CA2CA12CA9NFKBIARELA | |
| SCHEMBL2242888 | 0.70 | CA2 (1.00) | CA2CA12CA9CA1MMP1 | |
| SCHEMBL4823249 | 0.69 | CA2 (0.90) | CA2CA12CA9CA1KMT2A | |
| SCHEMBL13485922 | 0.69 | NFKBIA (1.00) | NFKBIARELAKMT2AMEN1MAPT | |
| SCHEMBL10494215 | 0.69 | CA2 (0.70) | CA2CA12CA9CA1MMP1 | |
| SCHEMBL5042092 | 0.68 | CA2 (0.71) | CA2CA12CA9CA1MMP1 |
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 |
|---|---|---|---|---|---|---|---|
| US-6939874-B2 | Substituted pyrimidinyl derivatives and methods of use | AMGEN INC. (US) | 2005-09-06 | — | — | US | disclosed |