Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.42 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.35 |
| ▸ | DRD1 | P21728 | 1/20 | 0.34 |
| ▸ | P2RX7 | Q99572 | 2/20 | 0.33 |
| ▸ | MAPT | P10636 | 5/20 | 0.33 |
| ▸ | HTT | P42858 | 5/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.33 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 4/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | TP53 | P04637 | 1/20 | 0.31 |
| ▸ | HTR1E | P28566 | 1/20 | 0.31 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.31 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.31 |
| ▸ | ADRA1A | P35348 | 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 | |
|---|---|---|---|---|
| SCHEMBL16961404 | 0.80 | MCHR1 (0.39) | ALDH1A1P2RX7KMT2AMEN1POLB | |
| SCHEMBL885349 | 0.79 | DRD1 (0.42) | ALDH1A1LRRK2DRD1MAPTHTT | |
| SCHEMBL12474316 | 0.78 | KMT2A (0.37) | ALDH1A1LRRK2DRD1MAPTHTT | |
| SCHEMBL4847783 | 0.76 | ALDH1A1 (0.40) | ALDH1A1LRRK2DRD1MAPTHTT | |
| SCHEMBL25435045 | 0.76 | ALDH1A1 (0.42) | ALDH1A1LRRK2DRD1P2RX7MAPT | |
| SCHEMBL16955000 | 0.76 | DRD1 (0.34) | ALDH1A1LRRK2DRD1P2RX7MAPT | |
| SCHEMBL900290 | 0.76 | ALDH1A1 (0.42) | ALDH1A1LRRK2DRD1P2RX7MAPT | |
| SCHEMBL900624 | 0.76 | ALDH1A1 (0.49) | ALDH1A1LRRK2DRD1P2RX7MAPT | |
| SCHEMBL16950831 | 0.76 | KMT2A (0.35) | ALDH1A1DRD1HTTKMT2AMEN1 | |
| SCHEMBL16962323 | 0.76 | ALDH1A1 (0.39) | ALDH1A1LRRK2DRD1P2RX7MAPT |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2900645-A1 | 3-PHENYLISOXAZOLIN DERIVATIVES WITH HERBICIDAL ACTION | Bayer CropScience AG (DE) | 2015-08-05 | — | — | EP | disclosed |
| EP-2621922-A1 | A PROCESS FOR THE SYNTHESIS OF THIO-TRIAZOLO-GROUP CONTAINING COMPOUNDS | BASF SE (DE) | 2013-08-07 | — | — | EP | disclosed |
| WO-2012041858-A1 | A PROCESS FOR THE SYNTHESIS OF THIO-TRIAZOLO-GROUP CONTAINING COMPOUNDS | BASF SE (DE) | 2012-04-05 | — | — | WO | disclosed |