Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ELANE | P08246 | 4/20 | 0.38 |
| ▸ | PDE4A | P27815 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.36 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.36 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 2/20 | 0.35 |
| ▸ | RAB9A | P51151 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 3/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL679150 | 0.84 | CCNA2 (0.39) | ELANEKMT2AADORA3ADORA2AADORA1 | |
| SCHEMBL30130685 | 0.80 | ELANE (0.36) | ELANEKMT2AADORA3ADORA2AADORA1 | |
| SCHEMBL679182 | 0.79 | CCNA2 (0.37) | ELANEKMT2AADORA3ADORA2AADORA1 | |
| SCHEMBL16244558 | 0.79 | PDE4A (0.41) | ELANEPDE4AKMT2AADORA3ADORA2A | |
| SCHEMBL24906233 | 0.78 | DGAT1 (0.37) | ELANEPDE4AKMT2AALDH1A1MAPT | |
| SCHEMBL27006523 | 0.78 | ALDH1A1 (0.40) | ELANEKMT2AADORA3ADORA2AADORA1 | |
| SCHEMBL27133315 | 0.78 | ALDH1A1 (0.40) | ELANEKMT2AADORA3ADORA2AADORA1 | |
| SCHEMBL1412525 | 0.77 | KMT2A (0.46) | ELANEKMT2AKDM4ETP53ALOX12 | |
| SCHEMBL27006438 | 0.75 | KDM4E (0.40) | ELANEADORA3ADORA2AADORA1KDM4E | |
| SCHEMBL2362313 | 0.74 | TSHR (0.40) | KMT2AALDH1A1HSD17B10GAATSHR |
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-2022250069-A1 | SULFUR-CONTAINING PYRAZOLE COMPOUND AND NOXIOUS ORGANISM CONTROL AGENT INCLUDING SULFUR-CONTAINING PYRAZOLE COMPOUND AS ACTIVE INGREDIENT | 三井化学アグロ株式会社 | 2022-12-01 | — | — | WO | disclosed |