Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESRRA | P11474 | 1/20 | 0.40 |
| ▸ | PSMD10 | O75832 | 1/20 | 0.40 |
| ▸ | CA1 | P00915 | 4/20 | 0.39 |
| ▸ | CA2 | P00918 | 4/20 | 0.39 |
| ▸ | CA9 | Q16790 | 4/20 | 0.39 |
| ▸ | CA12 | O43570 | 3/20 | 0.39 |
| ▸ | NOTUM | Q6P988 | 3/20 | 0.39 |
| ▸ | CA4 | P22748 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | P2RY14 | Q15391 | 1/20 | 0.37 |
| ▸ | GPR119 | Q8TDV5 | 3/20 | 0.36 |
| ▸ | DDT | P30046 | 2/20 | 0.36 |
| ▸ | AURKA | O14965 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL10195752 | 0.76 | GPR119 (0.40) | CA1CA2CA9CA12CA4 | |
| SCHEMBL31227601 | 0.69 | PSMD10 (0.52) | ESRRAPSMD10CA1CA2CA9 | |
| SCHEMBL25241550 | 0.69 | CA1 (0.48) | PSMD10CA1CA2CA9CA12 | |
| SCHEMBL10194877 | 0.68 | HPGD (0.44) | CA1CA9CA12POLBKMT2A | |
| SCHEMBL12393084 | 0.68 | GLA (0.51) | CA1CA2CA9CA12CA4 | |
| SCHEMBL12393083 | 0.68 | MIF (0.53) | CA1CA2CA9CA12POLB | |
| SCHEMBL21997183 | 0.68 | LCK (0.37) | CA1CA2CA9CA12POLB | |
| SCHEMBL4502703 | 0.67 | KDM4E (0.48) | L3MBTL1KMT2A | |
| SCHEMBL11959276 | 0.67 | LCK (0.49) | CA1CA2CA9CA12NOTUM | |
| SCHEMBL27852761 | 0.67 | MEN1 (0.56) | CA1CA12CA4L3MBTL1KMT2A |
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-2012084704-A1 | INDAZOLYL TRIAZOLE DERIVATIVES AS IRAK INHIBITORS | MERCK SERONO S.A. (CH) | 2012-06-28 | — | — | WO | disclosed |