Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 3/20 | 0.40 |
| ▸ | CA1 | P00915 | 2/20 | 0.40 |
| ▸ | CA12 | O43570 | 1/20 | 0.40 |
| ▸ | CA9 | Q16790 | 1/20 | 0.40 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.40 |
| ▸ | MKNK1 | Q9BUB5 | 7/20 | 0.38 |
| ▸ | MKNK2 | Q9HBH9 | 7/20 | 0.38 |
| ▸ | PARP10 | Q53GL7 | 2/20 | 0.37 |
| ▸ | PARP4 | Q9UKK3 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | PARP15 | Q460N3 | 1/20 | 0.37 |
| ▸ | PARP14 | Q460N5 | 1/20 | 0.37 |
| ▸ | PARP16 | Q8N5Y8 | 1/20 | 0.37 |
| ▸ | PARP11 | Q9NR21 | 1/20 | 0.37 |
| ▸ | PARP1 | P09874 | 2/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 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 | |
|---|---|---|---|---|
| SCHEMBL1002578 | 0.70 | CA2 (0.67) | CA2CA1CA12CA9CA14 | |
| SCHEMBL30248 | 0.67 | — | — | |
| Terephthalamide SCHEMBL23774 | 0.67 | PARP1 (0.71) | CA2CA1CA12CA9CA14 | |
| Hydrochloric Acid SCHEMBL5495092 | 0.66 | — | — | |
| SCHEMBL28610546 | 0.66 | CA2 (0.56) | CA2CA1CA12CA9CA14 | |
| SCHEMBL29059675 | 0.65 | CA2 (0.55) | CA2CA1CA12CA9CA14 | |
| Terephthalamide SCHEMBL11512422 | 0.65 | PARP1 (0.67) | CA2CA1CA12CA9CA14 | |
| Terephthalamide SCHEMBL15328883 | 0.65 | PARP1 (0.67) | CA2CA1CA12CA9CA14 | |
| Terephthalamide SCHEMBL1087289 | 0.65 | PARP1 (0.67) | CA2CA1CA12CA9CA14 | |
| Terephthalamide SCHEMBL1906838 | 0.65 | PARP1 (0.67) | CA2CA1CA12CA9CA14 |
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-2014059185-A1 | AMINO - DIHYDROTHIAZINE AND AMINO - DIOXIDO DIHYDROTHIAZINE COMPOUNDS AS BETA-SECRETASE ANTAGONISTS AND METHODS OF USE | AMGEN INC. (US) | 2014-04-17 | — | — | WO | disclosed |