Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRM4 | Q14833 | 11/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.38 |
| ▸ | HTR2C | P28335 | 1/20 | 0.38 |
| ▸ | HTR2B | P41595 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 4/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.37 |
| ▸ | NPC1 | O15118 | 2/20 | 0.37 |
| ▸ | RAB9A | P51151 | 2/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.36 |
| ▸ | USP2 | O75604 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL8633995 | 0.87 | MAPT (0.38) | GRM4ALDH1A1KDM4EKMT2AMAPT | |
| SCHEMBL8632028 | 0.86 | GRM4 (0.41) | GRM4ALDH1A1KDM4EKMT2ASMN1; SMN2 | |
| SCHEMBL8634665 | 0.74 | AVPR2 (0.41) | GRM4KDM4EHTR2CHTR2BGAA | |
| SCHEMBL4682595 | 0.72 | GRM4 (0.48) | GRM4HTR2C | |
| SCHEMBL8628611 | 0.71 | GRM4 (0.42) | GRM4ALDH1A1KDM4EKMT2AMAPT | |
| SCHEMBL8632070 | 0.71 | GRM4 (0.40) | GRM4ALDH1A1KDM4EKMT2AHTR2C | |
| SCHEMBL8627405 | 0.71 | GRM4 (0.41) | GRM4ALDH1A1KDM4EKMT2AMAPT | |
| SCHEMBL7334875 | 0.71 | GRM4 (0.45) | GRM4ALDH1A1KDM4EKMT2AHTR2C | |
| SCHEMBL7334873 | 0.71 | AVPR2 (0.54) | GRM4ALDH1A1KDM4EKMT2AHTR2C | |
| SCHEMBL4685058 | 0.70 | GRM4 (0.49) | GRM4HTR2C |
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-5753644-A | Vasopressin antagonist and oxytocin antagonist | OTSUKA PHARMACEUTICAL CO., LTD. (JP) | 1998-05-19 | — | — | US | disclosed |