Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR4 | Q13639 | 4/20 | 0.51 |
| ▸ | HTR3A | P46098 | 2/20 | 0.51 |
| ▸ | HTR1A | P08908 | 1/20 | 0.51 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.51 |
| ▸ | ACHE | P22303 | 1/20 | 0.51 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.51 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.51 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.51 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.45 |
| ▸ | CNR1 | P21554 | 1/20 | 0.44 |
| ▸ | CNR2 | P34972 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | PARP1 | P09874 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.43 |
| ▸ | HTR3B | O95264 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL24001298 | 0.90 | HTR4 (0.65) | HTR4HTR3AHTR1AADRA2CACHE | |
| SCHEMBL5316910 | 0.84 | HTR4 (0.51) | HTR4HTR3AHTR1AADRA2CACHE | |
| SCHEMBL5316418 | 0.80 | HDAC4 (0.45) | EPHX1CNR1CNR2LMNAPARP1 | |
| SCHEMBL534970 | 0.78 | HTR4 (0.68) | HTR4HTR3AADRA2CACHEADRA1A | |
| SCHEMBL8127466 | 0.77 | HTR4 (0.69) | HTR4HTR3AHTR1AADRA2CACHE | |
| SCHEMBL18094596 | 0.77 | HTR3E (0.59) | HTR3ACNR1CNR2LMNAPARP1 | |
| SCHEMBL18181734 | 0.77 | PARP1 (0.46) | HTR4HTR3AHTR1AADRA2CACHE | |
| SCHEMBL25557452 | 0.75 | HTR4 (0.53) | HTR4HTR3AHTR1AADRA2CACHE | |
| SCHEMBL12426360 | 0.75 | USP30 (0.52) | EPHX1LMNAPARP1POLBHDAC4 | |
| SCHEMBL29268419 | 0.75 | NPC1 (0.61) | EPHX1CNR1CNR2LMNAPOLB |
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 |
|---|---|---|---|---|---|---|---|
| WO-2007068739-A1 | 4-AMINO-BENZAMIDE DERIVATIVES AS 5-HT4 RECEPTOR AGONISTS FOR THE TREATMENT OF GASTROINTESTINAL, NEUROLOGICAL AND CARDIOVASCULAR DISORDERS | GLAXO GROUP LIMITED (GB) | 2007-06-21 | — | — | WO | disclosed |