Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OXTR | P30559 | 20/20 | 1.00 |
| ▸ | AVPR2 | P30518 | 4/20 | 0.83 |
| ▸ | AVPR1A | P37288 | 4/20 | 0.83 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.52 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.52 |
| ▸ | HTR3B | O95264 | 1/20 | 0.52 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.52 |
| ▸ | HTR1A | P08908 | 1/20 | 0.52 |
| ▸ | HTR1D | P28221 | 1/20 | 0.52 |
| ▸ | HTR1B | P28222 | 1/20 | 0.52 |
| ▸ | HTR2A | P28223 | 1/20 | 0.52 |
| ▸ | HTR2C | P28335 | 1/20 | 0.52 |
| ▸ | HTR1E | P28566 | 1/20 | 0.52 |
| ▸ | HTR1F | P30939 | 1/20 | 0.52 |
| ▸ | HTR7 | P34969 | 1/20 | 0.52 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.52 |
| ▸ | DRD3 | P35462 | 1/20 | 0.52 |
| ▸ | HTR2B | P41595 | 1/20 | 0.52 |
| ▸ | HTR3A | P46098 | 1/20 | 0.52 |
| ▸ | HTR5A | P47898 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL8093026 | 0.93 | OXTR (0.87) | OXTRAVPR2AVPR1AALDH1A1HTR3E | |
| SCHEMBL8095109 | 0.91 | OXTR (0.85) | OXTRAVPR2AVPR1AALDH1A1 | |
| SCHEMBL8081394 | 0.91 | OXTR (1.00) | OXTRAVPR2AVPR1AALDH1A1HTR3E | |
| SCHEMBL8092986 | 0.91 | OXTR (0.83) | OXTRAVPR2AVPR1AALDH1A1 | |
| SCHEMBL8081398 | 0.91 | OXTR (0.83) | OXTRAVPR2AVPR1AALDH1A1 | |
| SCHEMBL8092973 | 0.90 | OXTR (0.84) | OXTRAVPR2AVPR1AALDH1A1HTR3E | |
| SCHEMBL8088570 | 0.90 | OXTR (0.84) | OXTRAVPR2AVPR1AALDH1A1HTR3E | |
| SCHEMBL8095106 | 0.89 | OXTR (0.86) | OXTRAVPR2AVPR1AALDH1A1HTR3E | |
| SCHEMBL8088580 | 0.89 | OXTR (0.86) | OXTRAVPR2AVPR1AALDH1A1HTR3E | |
| Hydrochloric Acid SCHEMBL8089479 | 0.89 | OXTR (0.83) | OXTRAVPR2AVPR1AALDH1A1HTR3E |
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 |
|---|---|---|---|---|---|---|---|
| US-6090805-A | Tocolytic oxytocin receptor antagonists | MERCK & CO., INC. (US) | 2000-07-18 | — | — | US | disclosed |