Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | TRPA1 | O75762 | 4/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | ACACB | O00763 | 2/20 | 0.36 |
| ▸ | CTNNB1 | P35222 | 1/20 | 0.35 |
| ▸ | WNT3A | P56704 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | PTK2 | Q05397 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | IDO1 | P14902 | 1/20 | 0.33 |
| ▸ | NOS3 | P29474 | 1/20 | 0.32 |
| ▸ | NOS2 | P35228 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL9222771 | 0.81 | TRPA1 (0.39) | KMT2ATRPA1MAPTACACBGAA | |
| SCHEMBL23434901 | 0.80 | NOS1 (0.42) | KMT2ATRPA1MAPTACACBKDM4E | |
| SCHEMBL1144895 | 0.80 | NOS1 (0.42) | TRPA1MAPTACACBKDM4EIDO1 | |
| SCHEMBL24264863 | 0.77 | TRPA1 (0.39) | TRPA1ACACB | |
| SCHEMBL3595088 | 0.77 | TRPA1 (0.36) | KMT2ATRPA1MAPTACACBKDM4E | |
| SCHEMBL5771889 | 0.76 | TRPA1 (0.50) | KMT2ATRPA1MAPTACACBHTT | |
| SCHEMBL4403119 | 0.76 | ACACB (0.42) | TRPA1MAPTACACBCTNNB1WNT3A | |
| SCHEMBL1145116 | 0.76 | ACACB (0.42) | KMT2ATRPA1ACACBCTNNB1WNT3A | |
| SCHEMBL14500106 | 0.73 | NOS1 (0.50) | TRPA1MAPTHTTPTK2KDM4E | |
| SCHEMBL22186767 | 0.73 | TRPA1 (0.37) | KMT2ATRPA1MAPTHTTPTK2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2023250157-A9 | INHIBITORS OF MYCOBACTERIUM TUBERCULOSIS LIPOAMIDE DEHYDROGENASE | CORNELL UNIVERSITY (US) | 2024-01-25 | — | — | WO | disclosed |
| EP-2794611-B1 | PYRAZOLO[1,5-A]PYRIMIDINES AS ANTIVIRAL AGENTS | GILEAD SCIENCES INC (US) | 2017-10-11 | — | — | EP | disclosed |