Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | MAPT | P10636 | 3/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | AVPR1A | P37288 | 2/20 | 0.38 |
| ▸ | AVPR2 | P30518 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | AVPR1B | P47901 | 1/20 | 0.37 |
| ▸ | PYGL | P06737 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | ESR1 | P03372 | 2/20 | 0.35 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.35 |
| ▸ | SPTLC2 | O15270 | 1/20 | 0.35 |
| ▸ | USP2 | O75604 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.35 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL8631785 | 0.73 | ABCB1 (0.38) | ALDH1A1AVPR1AAVPR2LMNAESR1 | |
| SCHEMBL4685002 | 0.73 | AVPR2 (0.46) | ALDH1A1MAPTKDM4EAVPR1AAVPR2 | |
| SCHEMBL8632028 | 0.72 | GRM4 (0.41) | ALDH1A1KDM4EAVPR1AAVPR2KMT2A | |
| SCHEMBL4687862 | 0.68 | AVPR2 (0.47) | ALDH1A1AVPR1AAVPR2MEN1KMT2A | |
| SCHEMBL4684464 | 0.68 | AVPR2 (0.49) | ALDH1A1MAPTKDM4EAVPR1AAVPR2 | |
| SCHEMBL4683086 | 0.68 | AVPR2 (0.46) | ALDH1A1AVPR1AAVPR2MEN1KMT2A | |
| SCHEMBL4687810 | 0.66 | AVPR2 (0.48) | ALDH1A1AVPR1AAVPR2AVPR1BPYGL | |
| SCHEMBL4687283 | 0.66 | AVPR2 (0.51) | MAPTAVPR1AAVPR2MEN1KMT2A | |
| SCHEMBL4687153 | 0.66 | AVPR2 (0.48) | ALDH1A1AVPR1AAVPR2MEN1KMT2A | |
| SCHEMBL4687327 | 0.65 | AVPR2 (0.55) | MAPTAVPR1AAVPR2MEN1KMT2A |
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 |