Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SCN9A | Q15858 | 1/20 | 0.57 |
| ▸ | CCNE1 | P24864 | 10/20 | 0.53 |
| ▸ | CDK2 | P24941 | 10/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.50 |
| ▸ | LMNA | P02545 | 2/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.50 |
| ▸ | TSHR | P16473 | 1/20 | 0.50 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.50 |
| ▸ | HTT | P42858 | 1/20 | 0.50 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.48 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.48 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.48 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | RECQL | P46063 | 1/20 | 0.45 |
| ▸ | GAA | P10253 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL3718623 | 0.86 | KDM4E (0.58) | SCN9ACCNE1CDK2KDM4EALDH1A1 | |
| SCHEMBL3723029 | 0.81 | KDM4E (0.53) | CCNE1CDK2KDM4EALDH1A1LMNA | |
| SCHEMBL1734267 | 0.79 | PIK3CB (0.57) | KDM4EALDH1A1LMNASMN1; SMN2TSHR | |
| SCHEMBL3722028 | 0.78 | GRM2 (0.45) | SCN9AKDM4EALDH1A1LMNATSHR | |
| SCHEMBL3721246 | 0.78 | SCN9A (0.48) | SCN9AKDM4EALDH1A1LMNASMN1; SMN2 | |
| SCHEMBL3727320 | 0.76 | SCN9A (0.43) | SCN9AKDM4EALDH1A1LMNASMN1; SMN2 | |
| SCHEMBL3723259 | 0.75 | PTGS1 (0.48) | SCN9AKDM4EALDH1A1SMN1; SMN2HDAC3 | |
| SCHEMBL3720116 | 0.74 | SCN9A (0.47) | SCN9AKDM4ELMNACYP1A2CYP3A4 | |
| SCHEMBL787412 | 0.73 | SCN9A (1.00) | SCN9A | |
| SCHEMBL29421458 | 0.73 | SCN9A (1.00) | SCN9A |
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 |
|---|---|---|---|---|---|---|---|
| US-8614201-B2 | Heterocyclic amides as modulators of TRPA1 | JANSSEN PHARMACEUTICA NV (BE) | 2013-12-24 | — | — | US | disclosed |
| WO-2010141805-A1 | HETEROCYCLIC AMIDES AS MODULATORS OF TRPA1 | JANSSEN PHARMACEUTICA NV (BE) | 2010-12-09 | — | — | WO | disclosed |