Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTK2 | Q05397 | 1/20 | 0.36 |
| ▸ | ALOX5AP | P20292 | 1/20 | 0.36 |
| ▸ | FEN1 | P39748 | 1/20 | 0.36 |
| ▸ | EGFR | P00533 | 2/20 | 0.35 |
| ▸ | GAK | O14976 | 4/20 | 0.35 |
| ▸ | RIPK2 | O43353 | 3/20 | 0.35 |
| ▸ | COQ8A | Q8NI60 | 3/20 | 0.35 |
| ▸ | NLK | Q9UBE8 | 3/20 | 0.35 |
| ▸ | EPHB6 | O15197 | 2/20 | 0.35 |
| ▸ | ABL1 | P00519 | 2/20 | 0.35 |
| ▸ | ACVR1 | Q04771 | 2/20 | 0.35 |
| ▸ | STK16 | O75716 | 1/20 | 0.35 |
| ▸ | AAK1 | Q2M2I8 | 1/20 | 0.35 |
| ▸ | NQO2 | P16083 | 1/20 | 0.34 |
| ▸ | TNF | P01375 | 2/20 | 0.34 |
| ▸ | MAOA | P21397 | 1/20 | 0.33 |
| ▸ | NOS3 | P29474 | 1/20 | 0.32 |
| ▸ | NOS1 | P29475 | 1/20 | 0.32 |
| ▸ | NOS2 | P35228 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 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 | |
|---|---|---|---|---|
| SCHEMBL25385708 | 0.78 | MAOA (0.33) | GAKRIPK2COQ8ANLKMAOA | |
| SCHEMBL21713526 | 0.75 | NOS3 (0.34) | EGFRMAOANOS3NOS1NOS2 | |
| SCHEMBL3711280 | 0.75 | ALOX5AP (0.41) | ALOX5APFEN1GAKRIPK2COQ8A | |
| SCHEMBL30610404 | 0.74 | NQO2 (0.39) | ALOX5APFEN1EGFRGAKRIPK2 | |
| Methylamine SCHEMBL26629007 | 0.73 | MAOA (0.38) | ALOX5APFEN1EGFRGAKRIPK2 | |
| SCHEMBL28300760 | 0.73 | PSMD14 (0.38) | ALDH1A1GAARAB9ACA2TSHR | |
| SCHEMBL1899766 | 0.72 | NQO2 (0.38) | ALOX5APFEN1EGFRGAKRIPK2 | |
| SCHEMBL28190331 | 0.72 | MAOA (0.48) | ALOX5APFEN1EGFRGAKRIPK2 | |
| SCHEMBL30527538 | 0.71 | ALOX5AP (0.41) | ALOX5APFEN1EGFRGAKRIPK2 | |
| SCHEMBL25283372 | 0.71 | NQO2 (0.37) | ALOX5APFEN1EGFRGAKRIPK2 |
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-105263934-A | Pyrazolo-pyrrolidin-4-one derivatives as bet inhibitors and their use in the treatment of disease | NOVARTIS AG | 2016-01-20 | — | — | CN | disclosed |