Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRM4 | Q14833 | 8/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.38 |
| ▸ | MAPT | P10636 | 4/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.37 |
| ▸ | NPC1 | O15118 | 2/20 | 0.37 |
| ▸ | RAB9A | P51151 | 2/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 2/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.36 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.36 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | AVPR2 | P30518 | 2/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL7334875 | 0.84 | GRM4 (0.45) | GRM4ALDH1A1KDM4EKMT2AMAPT | |
| SCHEMBL4684901 | 0.79 | AVPR2 (0.47) | GRM4CHRM1AVPR2AVPR1AABCB11 | |
| SCHEMBL4682920 | 0.79 | HSD17B10 (0.43) | GRM4ALDH1A1KDM4EKMT2AMAPT | |
| SCHEMBL4685757 | 0.78 | MAPT (0.42) | GRM4ALDH1A1KDM4EKMT2AMAPT | |
| SCHEMBL9445082 | 0.78 | TAS1R3 (0.43) | GRM4ALDH1A1KDM4EKMT2AMAPT | |
| SCHEMBL4741540 | 0.77 | CHRM1 (0.42) | GRM4ALDH1A1KDM4EKMT2ARAB9A | |
| SCHEMBL8633995 | 0.76 | MAPT (0.38) | GRM4ALDH1A1KDM4EKMT2AMAPT | |
| SCHEMBL8631788 | 0.74 | AVPR2 (0.53) | CHRM1CHRM5CHRM3AVPR2AVPR1A | |
| SCHEMBL4685312 | 0.70 | AVPR2 (0.53) | ALDH1A1MAPTSMN1; SMN2CHRM1HPGD | |
| SCHEMBL4685362 | 0.69 | AVPR2 (0.51) | GRM4ALDH1A1KDM4EKMT2ACHRM1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1902717-A2 | Vasopressin antagonist and oxytocin antagonist | Otsuka Pharmaceutical Company, Limited (JP) | 2008-03-26 | — | — | EP | disclosed |
| EP-0620003-B1 | VASOPRESSIN ANTAGONIST AND OXYTOCIN ANTAGONIST | OTSUKA PHARMA CO LTD (JP) | 2008-01-16 | — | — | EP | disclosed |
| US-5622947-A | VASODILATORS, HYPOTENSIVE AGENTS, DIURETICS, PLATELET AGGLUTINATION INHIBITORS; ALSO USED TO PREVENT PREMATURE BIRTH, TREAT DYSMENORRHEA | OTSUKA PHARMACEUTICAL CO., LTD. (JP) | 1997-04-22 | — | — | US | disclosed |