Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SCN9A | Q15858 | 7/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.35 |
| ▸ | SCN10A | Q9Y5Y9 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | DRD2 | P14416 | 1/20 | 0.34 |
| ▸ | DRD4 | P21917 | 1/20 | 0.34 |
| ▸ | DRD3 | P35462 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | SCN5A | Q14524 | 1/20 | 0.33 |
| ▸ | SLC2A1 | P11166 | 2/20 | 0.33 |
| ▸ | SLC2A2 | P11168 | 2/20 | 0.33 |
| ▸ | SLC2A3 | P11169 | 2/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL17057898 | 0.87 | SMN1; SMN2 (0.38) | SMN1; SMN2KMT2AKDM4EALDH1A1LMNA | |
| SCHEMBL17058020 | 0.84 | GRM2 (0.38) | SCN9ASMN1; SMN2SCN10AKMT2AKDM4E | |
| SCHEMBL17058178 | 0.83 | SMN1; SMN2 (0.42) | SMN1; SMN2KMT2AKDM4EALDH1A1LMNA | |
| SCHEMBL11945054 | 0.83 | HSD17B10 (0.43) | SCN9ASMN1; SMN2KMT2AKDM4EALDH1A1 | |
| SCHEMBL17057968 | 0.82 | SCN9A (0.36) | SCN9ASMN1; SMN2SCN10AKMT2AKDM4E | |
| SCHEMBL17058249 | 0.81 | SCN9A (0.37) | SCN9ASMN1; SMN2SCN10AKMT2AALDH1A1 | |
| SCHEMBL11943944 | 0.79 | ALDH1A1 (0.54) | SCN9ASMN1; SMN2KMT2AKDM4EALDH1A1 | |
| SCHEMBL17058188 | 0.78 | NPC1 (0.39) | SMN1; SMN2KMT2AKDM4EALDH1A1LMNA | |
| SCHEMBL11945056 | 0.78 | KDM4E (0.58) | SCN9ASMN1; SMN2SCN10AKMT2AKDM4E | |
| SCHEMBL17057874 | 0.77 | NPC1 (0.40) | SMN1; SMN2KMT2AKDM4EALDH1A1LMNA |
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 |
|---|---|---|---|---|---|---|---|
| EP-2137179-B1 | PYRIDAZINONE DERIVATIVES USEFUL AS GLUCAN SYNTHASE INHIBITORS | MERCK SHARP & DOHME (US) | 2015-09-02 | — | — | EP | disclosed |