Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALOX5 | P09917 | 1/20 | 0.46 |
| ▸ | TP53 | P04637 | 1/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.45 |
| ▸ | DDB1 | Q16531 | 1/20 | 0.43 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.43 |
| ▸ | MAPT | P10636 | 3/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.42 |
| ▸ | MEN1 | O00255 | 2/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.42 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.42 |
| ▸ | RECQL | P46063 | 1/20 | 0.42 |
| ▸ | BACE1 | P56817 | 1/20 | 0.40 |
| ▸ | NPY1R | P25929 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | THRB | P10828 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL613824 | 0.84 | KDM1A (0.49) | ALOX5CYP3A4KMT2AALDH1A1BACE1 | |
| Ethylene SCHEMBL11097079 | 0.81 | KDM1A (0.47) | ALOX5KMT2AALDH1A1BACE1 | |
| SCHEMBL11706457 | 0.81 | ALOX5 (0.45) | ALOX5TP53CYP3A4DDB1CRBN | |
| SCHEMBL2296430 | 0.80 | KMT2A (0.49) | ALOX5TP53CYP3A4DDB1CRBN | |
| SCHEMBL27173361 | 0.77 | TP53 (0.45) | ALOX5TP53CYP3A4DDB1CRBN | |
| SCHEMBL31684572 | 0.74 | NOTUM (0.37) | TP53CYP3A4DDB1CRBNKMT2A | |
| SCHEMBL11706409 | 0.74 | KMT2A (0.43) | ALOX5TP53DDB1CRBNKMT2A | |
| SCHEMBL11706414 | 0.73 | KMT2A (0.50) | ALOX5TP53DDB1CRBNKMT2A | |
| SCHEMBL31684474 | 0.72 | NOTUM (0.43) | TP53CYP3A4KMT2AKDM4EHSD17B10 | |
| SCHEMBL31684499 | 0.72 | NOTUM (0.38) | TP53CYP3A4DDB1CRBNKMT2A |
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 |
|---|---|---|---|---|---|---|---|
| WO-2009156100-A1 | SUBSTITUTED ISOQUINOLINES AND ISOQUINOLINONES AS RHO KINASE INHIBITORS | SANOFI-AVENTIS (FR) | 2009-12-30 | — | — | WO | disclosed |