Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 4/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.43 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.43 |
| ▸ | KIF11 | P52732 | 2/20 | 0.40 |
| ▸ | KCNN4 | O15554 | 3/20 | 0.39 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.38 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.38 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | PKM | P14618 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | CES1 | P23141 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL27572797 | 0.84 | OPRM1 (0.44) | CYP1A2CYP2D6KMT2AMAPTCYP2C19 | |
| SCHEMBL5365607 | 0.80 | MAPT (0.46) | CYP1A2CYP2D6KMT2AMAPTCYP2C19 | |
| SCHEMBL2283147 | 0.79 | MAPT (0.48) | CYP1A2CYP2D6KMT2AMAPTCYP2C19 | |
| SCHEMBL28033810 | 0.77 | MAPT (0.47) | CYP1A2CYP2D6KMT2AMAPTCYP2C19 | |
| Propane SCHEMBL28558464 | 0.76 | MAPT (0.50) | CYP1A2CYP2D6KMT2AMAPTCYP2C19 | |
| SCHEMBL2763256 | 0.76 | KCNN4 (0.39) | KIF11KCNN4SMN1; SMN2 | |
| SCHEMBL9288039 | 0.75 | KCNN4 (0.42) | CYP1A2CYP2D6KMT2AKIF11KCNN4 | |
| SCHEMBL1363532 | 0.75 | MAPT (0.57) | CYP1A2CYP2D6KMT2AMAPTCYP2C19 | |
| SCHEMBL12505863 | 0.74 | CYP2D6 (0.38) | CYP1A2CYP2D6KMT2AMAPTKIF11 | |
| SCHEMBL3083611 | 0.74 | KMT2A (0.43) | CYP1A2CYP2D6KMT2AMAPTCYP2C19 |
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-105143206-A | Pyrimidine-2,4-diamine derivatives for treatment of cancer | THOMAS HELLEDAYS STIFTELSE F R MEDICINSK FORSKNING | 2015-12-09 | — | — | CN | disclosed |