Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 3/20 | 0.47 |
| ▸ | PNMT | P11086 | 1/20 | 0.44 |
| ▸ | AGXT | P21549 | 1/20 | 0.43 |
| ▸ | SYK | P43405 | 1/20 | 0.42 |
| ▸ | CSNK2A1 | P68400 | 2/20 | 0.41 |
| ▸ | MAOB | P27338 | 2/20 | 0.40 |
| ▸ | KMO | O15229 | 2/20 | 0.38 |
| ▸ | DAO | P14920 | 1/20 | 0.38 |
| ▸ | NOS3 | P29474 | 1/20 | 0.38 |
| ▸ | NOS1 | P29475 | 1/20 | 0.38 |
| ▸ | NOS2 | P35228 | 1/20 | 0.38 |
| ▸ | PTPN5 | P54829 | 2/20 | 0.38 |
| ▸ | BACE1 | P56817 | 1/20 | 0.38 |
| ▸ | NPBWR1 | P48145 | 1/20 | 0.38 |
| ▸ | ENPP2 | Q13822 | 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 | |
|---|---|---|---|---|
| SCHEMBL3718586 | 0.83 | KIF11 (0.56) | TAAR1AGXTSYKMAOB | |
| SCHEMBL717599 | 0.81 | DAO (0.48) | TAAR1PNMTCSNK2A1MAOBDAO | |
| SCHEMBL30152373 | 0.81 | DAO (0.48) | TAAR1PNMTCSNK2A1MAOBDAO | |
| Hydrochloric Acid SCHEMBL30152380 | 0.80 | IDO1 (0.49) | TAAR1PNMTCSNK2A1MAOBDAO | |
| SCHEMBL11199047 | 0.79 | MAOA (0.47) | SYKKMO | |
| SCHEMBL1041026 | 0.78 | ESR2 (0.52) | KMO | |
| SCHEMBL894079 | 0.77 | AGXT (0.69) | TAAR1AGXTSYKMAOBPTPN5 | |
| Hydrochloric Acid SCHEMBL3722991 | 0.76 | AGXT (0.67) | TAAR1AGXTSYKMAOBNOS3 | |
| SCHEMBL3791745 | 0.75 | LOXL2 (0.60) | TAAR1PNMTAGXTCSNK2A1NOS3 | |
| SCHEMBL3727416 | 0.75 | MAOB (0.61) | TAAR1PNMTAGXTSYKMAOB |
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 4 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 | claimed |
| WO-2010141805-A1 | HETEROCYCLIC AMIDES AS MODULATORS OF TRPA1 | JANSSEN PHARMACEUTICA NV (BE) | 2010-12-09 | — | — | WO | claimed |
| 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 |