Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AVPR2 | P30518 | 9/20 | 0.41 |
| ▸ | AVPR1A | P37288 | 6/20 | 0.41 |
| ▸ | OXTR | P30559 | 2/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | P2RX7 | Q99572 | 3/20 | 0.33 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.32 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.32 |
| ▸ | TAS1R2 | Q8TE23 | 1/20 | 0.32 |
| ▸ | HSP90B1 | P14625 | 2/20 | 0.32 |
| ▸ | TRAP1 | Q12931 | 2/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL7422025 | 0.90 | AVPR2 (0.42) | AVPR2AVPR1AOXTRP2RX7TAS1R3 | |
| SCHEMBL7421754 | 0.88 | AVPR2 (0.50) | AVPR2AVPR1AOXTRNPC1P2RX7 | |
| SCHEMBL7417501 | 0.86 | AVPR2 (0.40) | AVPR2AVPR1AOXTRMAPTP2RX7 | |
| SCHEMBL7420622 | 0.81 | AVPR2 (0.43) | AVPR2AVPR1AOXTR | |
| SCHEMBL7421267 | 0.76 | AVPR2 (0.38) | AVPR2AVPR1AOXTR | |
| SCHEMBL2313462 | 0.76 | HSD17B3 (0.32) | MAPTALDH1A1 | |
| SCHEMBL7549935 | 0.75 | BCAT2 (0.34) | AVPR2AVPR1AOXTRNPC1MAPT | |
| SCHEMBL7638228 | 0.75 | AVPR2 (0.57) | AVPR2AVPR1AOXTR | |
| SCHEMBL4394751 | 0.72 | AVPR2 (0.48) | AVPR2AVPR1AOXTR | |
| SCHEMBL7422271 | 0.71 | AVPR2 (0.52) | AVPR2AVPR1AOXTRP2RX7 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1000062-A1 | TRICYCLIC VASOPRESSIN AGONISTS | AMERICAN HOME PRODUCTS CORPORATION (US) | 2000-05-17 | — | — | EP | disclosed |
| WO-1999006409-A1 | TRICYCLIC VASOPRESSIN AGONISTS | AMERICAN HOME PRODUCTS CORPORATION (US) | 1999-02-11 | — | — | WO | disclosed |