Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS1 | P23219 | 1/20 | 0.48 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.46 |
| ▸ | TLR8 | Q9NR97 | 2/20 | 0.42 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.42 |
| ▸ | SYK | P43405 | 3/20 | 0.41 |
| ▸ | ESR1 | P03372 | 1/20 | 0.41 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 2/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.37 |
| ▸ | RAB9A | P51151 | 2/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.37 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.37 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.37 |
| ▸ | RELA | Q04206 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | CA1 | P00915 | 3/20 | 0.37 |
| ▸ | CA2 | P00918 | 3/20 | 0.37 |
| ▸ | CA9 | Q16790 | 3/20 | 0.37 |
| ▸ | HRH2 | P25021 | 1/20 | 0.37 |
| ▸ | HRH3 | Q9Y5N1 | 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 | |
|---|---|---|---|---|
| SCHEMBL3722029 | 0.84 | L3MBTL1 (0.44) | AGTR1SYKMAPK1RAB9ASMN1; SMN2 | |
| SCHEMBL3717583 | 0.84 | PTGS1 (0.56) | PTGS1PTGS2TLR8ESR1ESR2 | |
| SCHEMBL3727322 | 0.81 | AGTR1 (0.43) | AGTR1SYKKCNH3KDM4EALDH1A1 | |
| SCHEMBL3723259 | 0.79 | PTGS1 (0.48) | PTGS1PTGS2TLR8AGTR1SYK | |
| SCHEMBL3721197 | 0.79 | ADORA1 (0.51) | NPC1RAB9AKDM4EMAPTHPGD | |
| SCHEMBL3720119 | 0.77 | ACP1 (0.44) | AGTR1SYKHRH3KDM4EALDH1A1 | |
| SCHEMBL3720305 | 0.76 | PIK3CA (0.43) | AGTR1KMT2A | |
| SCHEMBL3717784 | 0.76 | ACP1 (0.47) | NPC1MAPK1RAB9AKMT2AMEN1 | |
| SCHEMBL3718669 | 0.75 | CA1 (0.54) | PTGS1PTGS2CA1CA2CA9 | |
| SCHEMBL3727142 | 0.74 | AGTR1 (0.43) | PTGS1PTGS2AGTR1NPC1RAB9A |
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 |