Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.44 |
| ▸ | BCL2 | P10415 | 1/20 | 0.39 |
| ▸ | IDO1 | P14902 | 1/20 | 0.38 |
| ▸ | NISCH | Q9Y2I1 | 1/20 | 0.37 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.35 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.35 |
| ▸ | TP53 | P04637 | 2/20 | 0.35 |
| ▸ | CTSS | P25774 | 1/20 | 0.35 |
| ▸ | CTSK | P43235 | 1/20 | 0.35 |
| ▸ | SIGMAR1 | Q99720 | 5/20 | 0.33 |
| ▸ | DHFR | P00374 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | KDR | P35968 | 1/20 | 0.32 |
| ▸ | TGFBR1 | P36897 | 1/20 | 0.32 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.32 |
| ▸ | KIF11 | P52732 | 1/20 | 0.31 |
| ▸ | MGLL | Q99685 | 1/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL27802181 | 0.86 | LOXL2 (0.41) | — | |
| SCHEMBL4156055 | 0.79 | CYP2A6 (0.39) | CYP1A2CYP2A6TSHR | |
| SCHEMBL3149855 | 0.78 | MAOA (0.36) | FGFR1MGLL | |
| SCHEMBL5198605 | 0.76 | TAAR1 (0.40) | CYP1A2CYP2A6TP53GAATSHR | |
| SCHEMBL11516832 | 0.76 | MAOA (0.47) | TP53TSHR | |
| SCHEMBL79020 | 0.75 | ALDH1A1 (0.35) | CYP2A6TSHR | |
| SCHEMBL27802178 | 0.75 | CYP1A2 (0.46) | CYP1A2CYP2A6TP53CYP2D6 | |
| SCHEMBL1719526 | 0.74 | GSTP1 (0.44) | CYP1A2NISCHTP53 | |
| SCHEMBL27683162 | 0.73 | TAAR1 (0.48) | CYP2A6TP53 | |
| SCHEMBL4216130 | 0.73 | ESR1 (0.38) | CYP1A2TP53 |
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-2632420-A1 | GLUTAMINE DERIVATIVES AS DEODORANTS | Givaudan SA (CH) | 2013-09-04 | — | — | EP | disclosed |
| WO-2012056014-A1 | GLUTAMINE DERIVATIVES AS DEODORANTS | GIVAUDAN SA (CH) | 2012-05-03 | — | — | WO | disclosed |