Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OXTR | P30559 | 16/20 | 0.78 |
| ▸ | AVPR2 | P30518 | 7/20 | 0.78 |
| ▸ | AVPR1A | P37288 | 7/20 | 0.78 |
| ▸ | AVPR1B | P47901 | 1/20 | 0.64 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.63 |
| ▸ | HTR3B | O95264 | 1/20 | 0.63 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.63 |
| ▸ | HTR1A | P08908 | 1/20 | 0.63 |
| ▸ | HTR1D | P28221 | 1/20 | 0.63 |
| ▸ | HTR1B | P28222 | 1/20 | 0.63 |
| ▸ | HTR2A | P28223 | 1/20 | 0.63 |
| ▸ | HTR2C | P28335 | 1/20 | 0.63 |
| ▸ | HTR1E | P28566 | 1/20 | 0.63 |
| ▸ | HTR1F | P30939 | 1/20 | 0.63 |
| ▸ | HTR7 | P34969 | 1/20 | 0.63 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.63 |
| ▸ | DRD3 | P35462 | 1/20 | 0.63 |
| ▸ | HTR2B | P41595 | 1/20 | 0.63 |
| ▸ | HTR3A | P46098 | 1/20 | 0.63 |
| ▸ | HTR5A | P47898 | 1/20 | 0.63 |
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 | |
|---|---|---|---|---|
| SCHEMBL7356903 | 0.88 | OXTR (0.80) | OXTRAVPR2AVPR1AAVPR1BHTR3E | |
| SCHEMBL7357751 | 0.87 | OXTR (0.77) | OXTRAVPR2AVPR1AAVPR1BHTR3E | |
| SCHEMBL7476021 | 0.86 | OXTR (0.71) | OXTRAVPR2AVPR1AAVPR1BHTR3E | |
| SCHEMBL8092941 | 0.78 | OXTR (0.67) | OXTRAVPR2AVPR1AAVPR1BHTR3E | |
| SCHEMBL8088545 | 0.78 | OXTR (1.00) | OXTRAVPR2AVPR1AHTR3EHTR3B | |
| SCHEMBL8089420 | 0.78 | OXTR (0.81) | OXTRAVPR2AVPR1AAVPR1BHTR3E | |
| SCHEMBL7485420 | 0.77 | OXTR (0.77) | OXTRAVPR2AVPR1AALDH1A1 | |
| SCHEMBL7441283 | 0.76 | OXTR (0.84) | OXTRAVPR2AVPR1AHTR3EHTR3B | |
| Hydrochloric Acid SCHEMBL7475350 | 0.76 | OXTR (0.83) | OXTRAVPR2AVPR1AHTR3EHTR3B | |
| SCHEMBL7357703 | 0.76 | OXTR (0.82) | OXTRAVPR2AVPR1AALDH1A1 |
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-1996022775-A1 | TOCOLYTIC OXYTOCIN RECEPTOR ANTAGONISTS | MERCK & CO., INC. (US) | 1996-08-01 | — | — | WO | disclosed |