Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 3/20 | 0.44 |
| ▸ | LMNA | P02545 | 3/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.39 |
| ▸ | THRB | P10828 | 1/20 | 0.39 |
| ▸ | CA12 | O43570 | 5/20 | 0.37 |
| ▸ | CA1 | P00915 | 5/20 | 0.37 |
| ▸ | CA2 | P00918 | 5/20 | 0.37 |
| ▸ | CA9 | Q16790 | 5/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | ATM | Q13315 | 1/20 | 0.33 |
| ▸ | TYMP | P19971 | 3/20 | 0.33 |
| ▸ | NOS1 | P29475 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 2/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL28818918 | 0.83 | KMT2A (0.48) | KMT2ALMNACYP2C19THRBCA12 | |
| SCHEMBL2360743 | 0.80 | KMT2A (0.43) | KMT2ALMNACYP2C19THRBCA12 | |
| SCHEMBL3835020 | 0.76 | LMNA (0.43) | KMT2ALMNACYP2C19THRBCA12 | |
| SCHEMBL7060299 | 0.76 | KMT2A (0.40) | KMT2ALMNACYP2C19THRBCA12 | |
| SCHEMBL10400098 | 0.76 | KMT2A (0.45) | KMT2ALMNACYP2C19THRBCA12 | |
| SCHEMBL27470889 | 0.73 | KMT2A (0.39) | KMT2ALMNACYP2C19THRBCA12 | |
| SCHEMBL9531382 | 0.73 | KMT2A (0.42) | KMT2ALMNACYP2C19THRBCA12 | |
| SCHEMBL16318595 | 0.73 | CYP2C19 (0.43) | KMT2ALMNACYP2C19THRBCA12 | |
| SCHEMBL21775519 | 0.73 | OPRK1 (0.38) | KMT2ALMNACYP2C19THRBCYP2D6 | |
| SCHEMBL296106 | 0.72 | LMNA (0.48) | KMT2ALMNACYP2C19THRBCA12 |
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 |
|---|---|---|---|---|---|---|---|
| CN-101668547-A | Select the alkalescence 2-nitroimidazole delivery agents and the application process thereof of oxygen-starved tissue | NATURAL PHARMACIA INTERNATIONA | 2010-03-10 | — | — | CN | disclosed |