Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1A | P08908 | 5/20 | 0.55 |
| ▸ | DRD2 | P14416 | 5/20 | 0.55 |
| ▸ | NPY1R | P25929 | 2/20 | 0.54 |
| ▸ | NPC1 | O15118 | 4/20 | 0.45 |
| ▸ | RAB9A | P51151 | 4/20 | 0.45 |
| ▸ | FLT3 | P36888 | 2/20 | 0.45 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.45 |
| ▸ | PIM1 | P11309 | 1/20 | 0.45 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.45 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.45 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.45 |
| ▸ | PIM3 | Q86V86 | 1/20 | 0.45 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.45 |
| ▸ | LMNA | P02545 | 2/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.44 |
| ▸ | BTK | Q06187 | 1/20 | 0.42 |
| ▸ | AURKA | O14965 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL6993221 | 0.99 | HTR1A (0.54) | HTR1ADRD2NPY1RNPC1RAB9A | |
| SCHEMBL7051385 | 0.88 | NPY1R (0.55) | NPY1RNPC1RAB9ASMN1; SMN2KDR | |
| SCHEMBL7051383 | 0.88 | NPY1R (0.55) | NPY1RNPC1RAB9ASMN1; SMN2KDR | |
| SCHEMBL7091275 | 0.87 | HTR1A (0.54) | HTR1ADRD2NPY1RNPC1RAB9A | |
| SCHEMBL6986658 | 0.86 | NPY1R (0.51) | HTR1ADRD2NPY1RNPC1NAMPT | |
| Hydrochloric Acid SCHEMBL6990799 | 0.86 | HTR1A (0.54) | HTR1ADRD2NPY1RNPC1RAB9A | |
| Hydrochloric Acid SCHEMBL6990046 | 0.86 | NPY1R (0.50) | HTR1ADRD2NPY1RNPC1LMNA | |
| SCHEMBL6992385 | 0.85 | NPY1R (0.55) | HTR1ADRD2NPY1RNPC1SMN1; SMN2 | |
| SCHEMBL7090266 | 0.85 | NPY1R (0.54) | HTR1ADRD2NPY1RNPC1RAB9A | |
| Hydrochloric Acid SCHEMBL6993006 | 0.85 | NPY1R (0.54) | HTR1ADRD2NPY1RNPC1SMN1; SMN2 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0915859-B1 | CERTAIN SUBSTITUTED BENZYLAMINE DERIVATIVES; A NEW CLASS OF NEUROPEPTIDE Y1 SPECIFIC LIGANDS | NEUROGEN CORP (US) | 2003-01-02 | — | — | EP | claimed |