Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 3/20 | 0.47 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.46 |
| ▸ | IDO1 | P14902 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | PAM | P19021 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | MTOR | P42345 | 1/20 | 0.37 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 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 | |
|---|---|---|---|---|
| SCHEMBL11700173 | 1.00 | HTR2A (0.47) | HTR2ASIGMAR1IDO1MEN1KMT2A | |
| SCHEMBL11700536 | 0.82 | HTR2A (0.46) | HTR2ASIGMAR1IDO1MEN1KMT2A | |
| SCHEMBL11700540 | 0.82 | HTR2A (0.46) | HTR2ASIGMAR1IDO1MEN1KMT2A | |
| SCHEMBL11704796 | 0.80 | HTR2A (0.45) | HTR2ASIGMAR1IDO1MEN1KMT2A | |
| SCHEMBL106152 | 0.80 | HTR2A (0.55) | HTR2ASIGMAR1IDO1MEN1KMT2A | |
| SCHEMBL453356 | 0.80 | HTR2A (0.55) | HTR2ASIGMAR1IDO1MEN1KMT2A | |
| SCHEMBL11019362 | 0.79 | PPARA (0.46) | HTR2ASIGMAR1IDO1MEN1KMT2A | |
| SCHEMBL11703329 | 0.79 | PPARA (0.46) | HTR2ASIGMAR1IDO1MEN1KMT2A | |
| SCHEMBL11702820 | 0.77 | PPARD (0.41) | HTR2ASIGMAR1IDO1MEN1KMT2A | |
| SCHEMBL11702813 | 0.77 | PPARD (0.41) | HTR2ASIGMAR1IDO1MEN1KMT2A |
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-4036886-A | FROM A PHENYL ALKENYL BROMIDE AND LITHIUM SALT OF A SCHIFF BASE OF ACETALDEHYDE | INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) | 1977-07-19 | — | — | US | disclosed |
| US-4031140-A | FLAVORS, ODORS | INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) | 1977-06-21 | — | — | US | disclosed |