Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DDR1 | Q08345 | 2/20 | 0.35 |
| ▸ | NR2E1 | Q9Y466 | 2/20 | 0.33 |
| ▸ | TLR2 | O60603 | 2/20 | 0.32 |
| ▸ | TLR1 | Q15399 | 2/20 | 0.32 |
| ▸ | PSEN1 | P49768 | 1/20 | 0.32 |
| ▸ | PSEN2 | P49810 | 1/20 | 0.32 |
| ▸ | APH1B | Q8WW43 | 1/20 | 0.32 |
| ▸ | NCSTN | Q92542 | 1/20 | 0.32 |
| ▸ | APH1A | Q96BI3 | 1/20 | 0.32 |
| ▸ | PSENEN | Q9NZ42 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.31 |
| ▸ | NPC1 | O15118 | 3/20 | 0.31 |
| ▸ | RAB9A | P51151 | 3/20 | 0.31 |
| ▸ | NLRP3 | Q96P20 | 1/20 | 0.31 |
| ▸ | IDH1 | O75874 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.30 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.30 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL18668542 | 0.82 | PTGS2 (0.45) | — | |
| SCHEMBL17459076 | 0.79 | HSP90AA1 (0.45) | DDR1TDP1NPC1RAB9AMAPT | |
| SCHEMBL17459077 | 0.78 | DDR1 (0.37) | DDR1TLR2TLR1KDM4ENPSR1 | |
| SCHEMBL17470151 | 0.78 | DDR1 (0.38) | DDR1NPC1RAB9AKDM4ESMN1; SMN2 | |
| SCHEMBL21925146 | 0.75 | NPC1 (0.44) | DDR1NPC1RAB9AKDM4ESMN1; SMN2 | |
| SCHEMBL18668492 | 0.74 | CYP3A4 (0.42) | NPC1RAB9AKDM4ESMN1; SMN2MAPT | |
| SCHEMBL18908832 | 0.73 | ALDH1A1 (0.35) | DDR1NPC1RAB9AKDM4ENPSR1 | |
| SCHEMBL18908820 | 0.73 | IL1B (0.33) | DDR1NPC1RAB9AKDM4ENPSR1 | |
| SCHEMBL19193723 | 0.72 | KDM4E (0.38) | DDR1TDP1NPC1RAB9AKDM4E | |
| SCHEMBL21985363 | 0.72 | NPC1 (0.33) | NPC1RAB9ASMN1; SMN2PKM |
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-2016012395-A1 | PESTICIDALLY ACTIVE HETEROCYCLIC DERIVATIVES WITH SULPHUR CONTAINING SUBSTITUENTS | SYNGENTA PARTICIPATIONS AG (CH) | 2016-01-28 | — | — | WO | disclosed |