Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA9 | Q16790 | 4/20 | 0.48 |
| ▸ | CA12 | O43570 | 3/20 | 0.48 |
| ▸ | CA1 | P00915 | 3/20 | 0.48 |
| ▸ | CA2 | P00918 | 3/20 | 0.48 |
| ▸ | CA14 | Q9ULX7 | 3/20 | 0.48 |
| ▸ | CA3 | P07451 | 2/20 | 0.48 |
| ▸ | CA4 | P22748 | 2/20 | 0.48 |
| ▸ | CA6 | P23280 | 2/20 | 0.48 |
| ▸ | CA5A | P35218 | 2/20 | 0.48 |
| ▸ | CA7 | P43166 | 2/20 | 0.48 |
| ▸ | CA13 | Q8N1Q1 | 2/20 | 0.48 |
| ▸ | CA5B | Q9Y2D0 | 2/20 | 0.48 |
| ▸ | GBA1 | P04062 | 6/20 | 0.47 |
| ▸ | MAPT | P10636 | 5/20 | 0.41 |
| ▸ | MEN1 | O00255 | 3/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.41 |
| ▸ | LMNA | P02545 | 3/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 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 | |
|---|---|---|---|---|
| SCHEMBL28088542 | 1.00 | CA9 (0.48) | CA9CA12CA1CA2CA14 | |
| Hydrochloric Acid SCHEMBL15758006 | 0.99 | CA9 (0.47) | CA9CA12CA1CA2CA14 | |
| Hydrochloric Acid SCHEMBL15758003 | 0.99 | CA9 (0.47) | CA9CA12CA1CA2CA14 | |
| Hydrochloric Acid SCHEMBL15758004 | 0.99 | CA9 (0.47) | CA9CA12CA1CA2CA14 | |
| SCHEMBL14975124 | 0.91 | GBA1 (0.47) | CA9CA12CA1CA2CA14 | |
| SCHEMBL14975122 | 0.91 | GBA1 (0.47) | CA9CA12CA1CA2CA14 | |
| Hydrochloric Acid SCHEMBL15757844 | 0.90 | GBA1 (0.46) | CA9CA12CA1CA2CA14 | |
| Hydrochloric Acid SCHEMBL15757842 | 0.90 | GBA1 (0.46) | CA9CA12CA1CA2CA14 | |
| Hydrochloric Acid SCHEMBL15757840 | 0.90 | GBA1 (0.46) | CA9CA12CA1CA2CA14 | |
| SCHEMBL14974421 | 0.89 | GBA1 (0.55) | CA9CA12CA1CA2CA14 |
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 |
|---|---|---|---|---|---|---|---|
| CN-105793254-A | Azaquinazoline carboxamide derivatives | 默克专利有限公司 | 2016-07-20 | — | — | CN | disclosed |