Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BACE1 | P56817 | 1/20 | 0.49 |
| ▸ | SNCA | P37840 | 2/20 | 0.48 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.44 |
| ▸ | ACR | P10323 | 2/20 | 0.44 |
| ▸ | TACR3 | P29371 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.43 |
| ▸ | USP2 | O75604 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 3/20 | 0.40 |
| ▸ | POLB | P06746 | 2/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | KIF11 | P52732 | 1/20 | 0.40 |
| ▸ | THRB | P10828 | 1/20 | 0.40 |
| ▸ | CASP1 | P29466 | 1/20 | 0.39 |
| ▸ | ALPL | P05186 | 4/20 | 0.39 |
| ▸ | CA9 | Q16790 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL27909175 | 0.84 | ALPL (0.55) | TACR3USP2MAPTALPLCA9 | |
| SCHEMBL27906348 | 0.81 | GAA (0.55) | BACE1ADORA3ACRMAPTPOLB | |
| SCHEMBL27906337 | 0.75 | SNCA (0.64) | SNCAACRTACR3KDM4EMAPT | |
| SCHEMBL2566128 | 0.74 | ALPL (0.69) | SNCAACRTACR3KDM4ETP53 | |
| SCHEMBL3051778 | 0.72 | NPC1 (0.61) | SNCAACRKDM4ECYP2C19NR1H4 | |
| SCHEMBL21856003 | 0.72 | SNCA (0.53) | SNCAACRTACR3KDM4EMAPT | |
| SCHEMBL4090739 | 0.72 | ALPL (0.70) | SNCAACRMAPTPOLBTP53 | |
| SCHEMBL1925415 | 0.72 | SNCA (0.48) | SNCAADORA3ACRTACR3KDM4E | |
| SCHEMBL27842915 | 0.71 | BACE1 (0.48) | BACE1ADORA3KDM4EUSP2ALDH1A1 | |
| SCHEMBL7841174 | 0.71 | RAF1 (0.49) | SNCAKDM4EMAPTPOLBTHRB |
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-102317263-B | Halogen substituted compounds as pesticides | BAYER IP GMBH | 2015-04-22 | — | — | CN | disclosed |