Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1H4 | Q96RI1 | 3/20 | 0.71 |
| ▸ | RAB9A | P51151 | 7/20 | 0.69 |
| ▸ | NPC1 | O15118 | 6/20 | 0.69 |
| ▸ | ACHE | P22303 | 2/20 | 0.58 |
| ▸ | BCHE | P06276 | 1/20 | 0.58 |
| ▸ | MEN1 | O00255 | 2/20 | 0.55 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.55 |
| ▸ | HPGD | P15428 | 1/20 | 0.55 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.55 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.51 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.51 |
| ▸ | TP53 | P04637 | 2/20 | 0.51 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.51 |
| ▸ | NFKB1 | P19838 | 3/20 | 0.50 |
| ▸ | NFKB2 | Q00653 | 3/20 | 0.50 |
| ▸ | RELA | Q04206 | 3/20 | 0.50 |
| ▸ | SIRT2 | Q8IXJ6 | 2/20 | 0.49 |
| ▸ | MAPT | P10636 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.48 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL29449760 | 0.90 | NR1H4 (0.85) | NR1H4RAB9ANPC1MEN1KMT2A | |
| SCHEMBL11323465 | 0.85 | NR1H4 (0.78) | NR1H4RAB9ANPC1ACHEBCHE | |
| SCHEMBL16592554 | 0.85 | NR1H4 (0.78) | NR1H4RAB9ANPC1ACHEBCHE | |
| SCHEMBL27811784 | 0.84 | ACHE (0.57) | NR1H4RAB9ANPC1ACHEBCHE | |
| SCHEMBL29147530 | 0.84 | NPC1 (0.72) | NR1H4RAB9ANPC1ACHEBCHE | |
| SCHEMBL27001834 | 0.84 | NR1H4 (0.70) | NR1H4RAB9ANPC1ACHEBCHE | |
| SCHEMBL27001784 | 0.84 | NPC1 (0.72) | RAB9ANPC1ACHEBCHEMEN1 | |
| SCHEMBL19244915 | 0.84 | ACHE (0.57) | NR1H4RAB9ANPC1ACHEBCHE | |
| SCHEMBL16592595 | 0.84 | ACHE (0.57) | NR1H4RAB9ANPC1ACHEBCHE | |
| SCHEMBL27001819 | 0.84 | NPC1 (0.72) | NR1H4RAB9ANPC1ACHEBCHE |
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-4304630-A1 | SMALL MOLECULE ANTAGONISTS FOR THE RELAXIN-3/RXFP3 SYSTEM | Research Triangle Institute (US) | 2024-01-17 | — | — | EP | disclosed |
| WO-2022192126-A1 | SMALL MOLECULE ANTAGONISTS FOR THE RELAXIN-3/RXFP3 SYSTEM | RESEARCH TRIANGLE INSTITUTE (US) | 2022-09-15 | — | — | WO | disclosed |