Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM1A | O60341 | 3/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.39 |
| ▸ | BACE1 | P56817 | 4/20 | 0.38 |
| ▸ | BACE2 | Q9Y5Z0 | 1/20 | 0.38 |
| ▸ | DHFR | P00374 | 1/20 | 0.35 |
| ▸ | NOS3 | P29474 | 1/20 | 0.35 |
| ▸ | NOS2 | P35228 | 1/20 | 0.35 |
| ▸ | IKBKB | O14920 | 1/20 | 0.35 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.34 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.34 |
| ▸ | XDH | P47989 | 1/20 | 0.34 |
| ▸ | RCOR1 | Q9UKL0 | 1/20 | 0.34 |
| ▸ | SHMT1 | P34896 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL9718903 | 0.77 | BACE1 (0.41) | KDM1ABACE1BACE2KMT2A | |
| SCHEMBL3107125 | 0.69 | KDM1A (0.42) | KDM1ATSHRMAPK1SLC6A4BACE1 | |
| SCHEMBL1391271 | 0.69 | DHFR (0.43) | KDM1ATSHRMAPK1SLC6A4BACE1 | |
| SCHEMBL16014198 | 0.68 | KDM1A (0.43) | KDM1ATSHRMAPK1SLC6A4BACE1 | |
| SCHEMBL1172321 | 0.68 | KDM1A (0.43) | KDM1ATSHRMAPK1SLC6A4BACE1 | |
| SCHEMBL1420518 | 0.65 | KDM1A (0.59) | KDM1ATSHRMAPK1SLC6A4SLC6A3 | |
| SCHEMBL6232785 | 0.65 | KDM1A (0.43) | KDM1ATSHRMAPK1SLC6A4BACE1 | |
| Hydrochloric Acid SCHEMBL3001569 | 0.64 | KDM1A (0.57) | KDM1ATSHRMAPK1SLC6A4SLC6A3 | |
| SCHEMBL22369879 | 0.63 | KDM1A (0.56) | KDM1ATSHRMAPK1SLC6A4BACE1 | |
| SCHEMBL18769566 | 0.63 | SLC6A4 (0.58) | KDM1ASLC6A4SLC6A3SLC6A2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2231624-A2 | TRIAZINES AND RELATED COMPOUNDS HAVING ANTIVIRAL ACTIVITY, COMPOSITIONS AND METHODS THEREOF | Progenics Pharmaceuticals, Inc. (US) | 2010-09-29 | — | — | EP | disclosed |
| WO-2009091388-A2 | TRIAZINES AND RELATED COMPOUNDS HAVING ANTIVIRAL ACTIVITY, COMPOSITIONS AND METHODS THEREOF | PROGENICS PHARMACEUTICALS, INC. (US) | 2009-07-23 | — | — | WO | disclosed |