Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.51 |
| ▸ | RAB9A | P51151 | 1/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.43 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.43 |
| ▸ | RELA | Q04206 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.42 |
| ▸ | MAPT | P10636 | 2/20 | 0.42 |
| ▸ | PIK3CA | P42336 | 2/20 | 0.41 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | GFER | P55789 | 1/20 | 0.40 |
| ▸ | KMO | O15229 | 1/20 | 0.40 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL17801689 | 0.82 | NPC1 (0.56) | NPC1RAB9AKDM4ELMNANFKB1 | |
| SCHEMBL17801309 | 0.81 | NPC1 (0.55) | NPC1RAB9AKDM4ELMNANFKB1 | |
| SCHEMBL20519387 | 0.79 | NPC1 (0.51) | NPC1RAB9AKDM4ELMNANFKB1 | |
| SCHEMBL17803457 | 0.78 | NPC1 (0.47) | NPC1RAB9AKDM4ELMNAALOX5 | |
| SCHEMBL17801295 | 0.78 | DYRK1A (0.54) | NPC1RAB9AKDM4ELMNANFKB1 | |
| SCHEMBL17801340 | 0.77 | NPC1 (0.61) | NPC1RAB9AKDM4ELMNANFKB1 | |
| SCHEMBL17801688 | 0.76 | KDM4E (0.74) | NPC1RAB9AKDM4ELMNANFKB1 | |
| SCHEMBL17801198 | 0.76 | RAB9A (0.60) | NPC1RAB9AKDM4ELMNASMN1; SMN2 | |
| SCHEMBL17801257 | 0.76 | NPC1 (0.60) | NPC1RAB9AKDM4ELMNASMN1; SMN2 | |
| SCHEMBL17801360 | 0.75 | NPC1 (0.58) | NPC1RAB9AKDM4ELMNASMN1; SMN2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3227301-A1 | BICYCLIC COMPOUNDS AS PEST CONTROL AGENTS | Bayer CropScience AG (DE) | 2017-10-11 | — | — | EP | disclosed |
| WO-2016087417-A1 | BICYCLIC COMPOUNDS AS PEST CONTROL AGENTS | BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) | 2016-06-09 | — | — | WO | disclosed |