Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DGAT1 | O75907 | 1/20 | 0.35 |
| ▸ | CA12 | O43570 | 3/20 | 0.33 |
| ▸ | CA14 | Q9ULX7 | 3/20 | 0.33 |
| ▸ | CA2 | P00918 | 2/20 | 0.33 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.33 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.33 |
| ▸ | RELA | Q04206 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | CTSK | P43235 | 4/20 | 0.32 |
| ▸ | CA1 | P00915 | 2/20 | 0.32 |
| ▸ | CA7 | P43166 | 2/20 | 0.32 |
| ▸ | MIF | P14174 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | NPC1 | O15118 | 1/20 | 0.30 |
| ▸ | RECQL | P46063 | 1/20 | 0.30 |
| ▸ | RAB9A | P51151 | 1/20 | 0.30 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL19369636 | 0.82 | CTSK (0.38) | DGAT1CA12CA14CA2NFKB1 | |
| SCHEMBL101218 | 0.72 | DGAT1 (0.46) | DGAT1CA12CA14CA2NFKB1 | |
| SCHEMBL20748762 | 0.71 | CTSK (0.36) | DGAT1CA12CA14CA2NFKB1 | |
| SCHEMBL12246341 | 0.71 | CA1 (0.39) | DGAT1CA12CA14CA2NFKB1 | |
| SCHEMBL3509747 | 0.71 | DGAT1 (0.46) | DGAT1CA12CA14CA2NFKB1 | |
| SCHEMBL6272856 | 0.70 | DGAT1 (0.44) | DGAT1CA12CA14CA2NFKB1 | |
| SCHEMBL1522412 | 0.70 | DGAT1 (0.44) | DGAT1CA12CA14CA2NFKB1 | |
| SCHEMBL303868 | 0.70 | — | — | |
| Potassium SCHEMBL29554503 | 0.70 | DGAT1 (0.44) | DGAT1CA12CA14CA2NFKB1 | |
| SCHEMBL20656498 | 0.69 | MAOA (0.37) | DGAT1CA12CA14CA2NFKB1 |
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-2023130054-A2 | HETEROARYL COMPOUNDS AS INHIBITORS OF IRAK4, COMPOSITIONS AND APPLICATIONS THEREOF | ACCRO BIOSCIENCE (HK) LIMITED (CN) | 2023-07-06 | — | — | WO | disclosed |