Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 1/20 | 0.40 |
| ▸ | BRD4 | O60885 | 1/20 | 0.40 |
| ▸ | BRD2 | P25440 | 1/20 | 0.40 |
| ▸ | BRD3 | Q15059 | 1/20 | 0.40 |
| ▸ | BRDT | Q58F21 | 1/20 | 0.40 |
| ▸ | HSD17B3 | P37058 | 1/20 | 0.39 |
| ▸ | CCKBR | P32239 | 4/20 | 0.38 |
| ▸ | CCKAR | P32238 | 3/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.38 |
| ▸ | CAPN1 | P07384 | 1/20 | 0.38 |
| ▸ | ADCY10 | Q96PN6 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.37 |
| ▸ | ULK1 | O75385 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL28042524 | 0.83 | PARP1 (0.54) | PARP1CAPN1KDM4EALDH1A1SCN9A | |
| SCHEMBL15639397 | 0.71 | NPC1 (0.53) | L3MBTL1ALDH1A1 | |
| SCHEMBL29572327 | 0.71 | NPC1 (0.53) | L3MBTL1ALDH1A1 | |
| SCHEMBL29626876 | 0.70 | BCAT2 (0.44) | PARP1CAPN1KDM4EALDH1A1 | |
| SCHEMBL6262435 | 0.70 | DRD2 (0.54) | — | |
| SCHEMBL10847700 | 0.69 | HPGD (0.48) | KDM4EALDH1A1SCN9AULK1 | |
| SCHEMBL883582 | 0.69 | POLB (0.69) | L3MBTL1KDM4EALDH1A1GAA | |
| SCHEMBL30452120 | 0.69 | POLB (0.69) | L3MBTL1KDM4EALDH1A1GAA | |
| SCHEMBL11410287 | 0.69 | GAA (0.63) | BRD4BRD2BRD3BRDTL3MBTL1 | |
| SCHEMBL12528566 | 0.69 | BCHE (0.58) | L3MBTL1CAPN1KDM4EALDH1A1SCN9A |
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-105101800-A | Heterocyclic compounds as pesticides | BAYER CROPSCIENCE AG | 2015-11-25 | — | — | CN | disclosed |