Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 3/20 | 0.59 |
| ▸ | MAPT | P10636 | 1/20 | 0.59 |
| ▸ | HTT | P42858 | 1/20 | 0.59 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.58 |
| ▸ | IDE | P14735 | 1/20 | 0.55 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.55 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.55 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.55 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.53 |
| ▸ | XBP1 | P17861 | 1/20 | 0.53 |
| ▸ | STAT3 | P40763 | 1/20 | 0.53 |
| ▸ | GSK3A | P49840 | 1/20 | 0.53 |
| ▸ | GSK3B | P49841 | 1/20 | 0.53 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.53 |
| ▸ | CDK5R1 | Q15078 | 1/20 | 0.53 |
| ▸ | PPARG | P37231 | 1/20 | 0.51 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.51 |
| ▸ | NR2E3 | Q9Y5X4 | 1/20 | 0.51 |
| ▸ | NCOR2 | Q9Y618 | 1/20 | 0.51 |
| ▸ | ABL1 | P00519 | 6/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL19553909 | 0.87 | CYP1A2 (0.53) | KMT2AMAPTHTTCYP1A2IDE | |
| SCHEMBL22628312 | 0.87 | PRKCA (0.54) | KMT2AMAPTHTTCYP1A2IDE | |
| SCHEMBL19554542 | 0.81 | ABL1 (0.53) | KMT2AMAPTHTTCYP1A2IDE | |
| SCHEMBL28884641 | 0.81 | CYP1A2 (0.57) | KMT2AMAPTHTTCYP1A2IDE | |
| SCHEMBL29933958 | 0.81 | CYP1A2 (0.57) | KMT2AMAPTHTTCYP1A2IDE | |
| SCHEMBL21004279 | 0.80 | CYP1A2 (0.53) | KMT2AMAPTHTTCYP1A2IDE | |
| SCHEMBL21004557 | 0.79 | CYP1A2 (0.46) | KMT2AMAPTHTTCYP1A2IDE | |
| SCHEMBL21004280 | 0.79 | CYP1A2 (0.49) | KMT2AMAPTHTTCYP1A2IDE | |
| SCHEMBL31359359 | 0.77 | CYP1A2 (0.56) | KMT2AMAPTHTTCYP1A2IDE | |
| SCHEMBL15966858 | 0.77 | AURKA (0.63) | KMT2AMAPTHTTCYP1A2IDE |
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-109415343-A | For treating substituted 2,4- diamino-quinoline of proliferative diseases | 基因科学医药公司 | 2019-03-01 | — | — | CN | disclosed |