Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AVPR2 | P30518 | 18/20 | 0.74 |
| ▸ | AVPR1A | P37288 | 13/20 | 0.74 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.74 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.74 |
| ▸ | HTR1A | P08908 | 1/20 | 0.74 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.74 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.74 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.74 |
| ▸ | HTR2C | P28335 | 1/20 | 0.74 |
| ▸ | HRH1 | P35367 | 1/20 | 0.74 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.74 |
| ▸ | GLP1R | P43220 | 1/20 | 0.74 |
| ▸ | TMEM97 | Q5BJF2 | 1/20 | 0.74 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.74 |
| ▸ | GPR119 | Q8TDV5 | 1/20 | 0.74 |
| ▸ | OXTR | P30559 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL7343456 | 0.90 | AVPR2 (0.75) | AVPR2AVPR1AABCB11ADRB2HTR1A | |
| SCHEMBL7352820 | 0.89 | AVPR2 (0.59) | AVPR2AVPR1AABCB11ADRB2HTR1A | |
| Hydrochloric Acid SCHEMBL7355178 | 0.85 | AVPR2 (0.55) | AVPR2AVPR1AABCB11ADRB2HTR1A | |
| Tolvaptan SCHEMBL31206968 | 0.85 | AVPR2 (1.00) | AVPR2AVPR1AABCB11ADRB2HTR1A | |
| Tolvaptan SCHEMBL242421 | 0.85 | AVPR2 (1.00) | AVPR2AVPR1AABCB11ADRB2HTR1A | |
| SCHEMBL8246087 | 0.85 | AVPR2 (1.00) | AVPR2AVPR1AABCB11ADRB2HTR1A | |
| Tolvaptan SCHEMBL29389767 | 0.85 | AVPR2 (1.00) | AVPR2AVPR1AABCB11ADRB2HTR1A | |
| Tolvaptan SCHEMBL1650272 | 0.85 | AVPR2 (1.00) | AVPR2AVPR1AABCB11ADRB2HTR1A | |
| Tolvaptan SCHEMBL20769792 | 0.85 | AVPR2 (1.00) | AVPR2AVPR1AABCB11ADRB2HTR1A | |
| Tolvaptan SCHEMBL29776655 | 0.85 | AVPR2 (1.00) | AVPR2AVPR1AABCB11ADRB2HTR1A |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5753677-A | Benzoheterocyclic compounds | OTSUKA PHARMACEUTICAL CO., LTD. (JP) | 1998-05-19 | — | — | US | claimed |
| EP-0450097-B1 | BENZOHETEROCYCLIC COMPOUNDS | OTSUKA PHARMA CO LTD (JP) | 1996-04-24 | — | — | EP | claimed |
| EP-0602209-A1 | OXYTOCIN ANTAGONIST | OTSUKA PHARMACEUTICAL CO., LTD. (JP) | 1994-06-22 | — | — | EP | claimed |
| WO-1994001113-A1 | OXYTOCIN ANTAGONIST | OTSUKA PHARMACEUTICAL COMPANY, LIMITED (JP) | 1994-01-20 | — | — | WO | claimed |