Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 14/20 | 0.62 |
| ▸ | CA5A | P35218 | 3/20 | 0.62 |
| ▸ | CA1 | P00915 | 10/20 | 0.55 |
| ▸ | CA9 | Q16790 | 10/20 | 0.48 |
| ▸ | CA12 | O43570 | 8/20 | 0.48 |
| ▸ | CA14 | Q9ULX7 | 3/20 | 0.48 |
| ▸ | CA4 | P22748 | 2/20 | 0.48 |
| ▸ | CA13 | Q8N1Q1 | 3/20 | 0.42 |
| ▸ | CA3 | P07451 | 1/20 | 0.42 |
| ▸ | CA6 | P23280 | 1/20 | 0.42 |
| ▸ | CA7 | P43166 | 1/20 | 0.42 |
| ▸ | PLA2G7 | Q13093 | 1/20 | 0.42 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.42 |
| ▸ | GLO1 | Q04760 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | ANXA2 | P07355 | 1/20 | 0.40 |
| ▸ | S100A10 | P60903 | 1/20 | 0.40 |
| ▸ | NOS1 | P29475 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL16407107 | 0.77 | CA2 (1.00) | CA2CA5ACA1CA9CA12 | |
| SCHEMBL28183847 | 0.76 | ALDH1A1 (0.44) | CA2CA5AALDH1A1POLBMAPT | |
| SCHEMBL7136145 | 0.76 | CA2 (0.61) | CA2CA5ACA1CA9CA12 | |
| SCHEMBL2398133 | 0.73 | CA2 (1.00) | CA2CA5ACA1CA9CA12 | |
| SCHEMBL791765 | 0.72 | CA2 (0.67) | CA2CA5ACA1CA9CA12 | |
| SCHEMBL31408760 | 0.71 | CYP3A4 (0.46) | CA2CA5ACA1CA9CA12 | |
| SCHEMBL7188784 | 0.71 | ALDH1A1 (0.42) | CA2CA5AALDH1A1POLBMAPT | |
| SCHEMBL11056267 | 0.71 | CYP3A4 (0.46) | CA2CA5ACA1CA9CA12 | |
| SCHEMBL10446480 | 0.69 | ANXA2 (0.57) | CA2CA5ACA1CA9CA12 | |
| SCHEMBL5633878 | 0.68 | CA2 (0.55) | CA2CA5ACA1CA9CA12 |
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-2817310-B1 | 8-SUBSTITUTED 2-AMINO-[1,2,4]TRIAZOLO[1,5-A]PYRAZINES AS SYK TRYROSINE KINASE INHIBITORS AND GCN2 SERIN KINASE INHIBITORS | MERCK PATENT GMBH (DE) | 2018-03-21 | — | — | EP | disclosed |