Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MGMT | P16455 | 7/20 | 0.37 |
| ▸ | MAPT | P10636 | 5/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | PSMD14 | O00487 | 1/20 | 0.34 |
| ▸ | PRKACA | P17612 | 1/20 | 0.34 |
| ▸ | CASP6 | P55212 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 4/20 | 0.33 |
| ▸ | LMNA | P02545 | 4/20 | 0.33 |
| ▸ | NPC1 | O15118 | 3/20 | 0.33 |
| ▸ | RAB9A | P51151 | 3/20 | 0.33 |
| ▸ | HPGD | P15428 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | XBP1 | P17861 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | TLR9 | Q9NR96 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | MITF | O75030 | 2/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL2926719 | 0.98 | MGMT (0.36) | MGMTMAPTKMT2AMEN1PSMD14 | |
| Hydrochloric Acid SCHEMBL2935264 | 0.89 | MGMT (0.35) | MGMTMAPTKMT2AMEN1PSMD14 | |
| Trifluoroacetic Acid SCHEMBL3597812 | 0.88 | MGMT (0.34) | MGMTMAPTKMT2AMEN1PSMD14 | |
| Trifluoroacetic Acid SCHEMBL3606360 | 0.80 | HRH4 (0.40) | MGMTMAPTKMT2AMEN1PSMD14 | |
| Formic Acid SCHEMBL3606800 | 0.75 | LMNA (0.36) | MGMTMAPTKMT2AMEN1HTT | |
| SCHEMBL11665903 | 0.74 | MAPT (0.42) | MGMTMAPTKMT2AMEN1PSMD14 | |
| SCHEMBL29581128 | 0.74 | MAPT (0.42) | MGMTMAPTKMT2AMEN1PSMD14 | |
| SCHEMBL30578394 | 0.73 | KMT2A (0.43) | MGMTMAPTKMT2AMEN1PSMD14 | |
| SCHEMBL28231619 | 0.73 | KMT2A (0.43) | MGMTMAPTKMT2AMEN1PSMD14 | |
| SCHEMBL15972473 | 0.72 | MAPT (0.41) | MAPTKMT2AMEN1HTTLMNA |
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-2229392-A1 | TRIAZOLOTRIAZINES AND TRIAZOLOPYRAZINES AND THEIR USE AS GSK3BETA INHIBITORS | Bayer Schering Pharma Aktiengesellschaft (DE) | 2010-09-22 | — | — | EP | disclosed |
| WO-2009074259-A1 | TRIAZOLOTRIAZINES AND TRIAZOLOPYRAZINES AND THE USE THEREOF | BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) | 2009-06-18 | — | — | WO | disclosed |