Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 5/20 | 0.36 |
| ▸ | MGLL | Q99685 | 1/20 | 0.36 |
| ▸ | USP2 | O75604 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.32 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.32 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.32 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.32 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.32 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.32 |
| ▸ | GRIN3A | Q8TCU5 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 2/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 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 | |
|---|---|---|---|---|
| SCHEMBL24405725 | 0.84 | MAOA (0.39) | ALDH1A1KDM4EMEN1KMT2ARAB9A | |
| SCHEMBL12957096 | 0.73 | SIGMAR1 (0.48) | SIGMAR1TSHRALDH1A1TP53 | |
| SCHEMBL20344637 | 0.73 | TP53 (0.35) | SIGMAR1ALDH1A1TP53LMNAMAPT | |
| SCHEMBL5535851 | 0.73 | SIGMAR1 (0.45) | SIGMAR1 | |
| SCHEMBL23997352 | 0.70 | ALDH1A1 (0.34) | ALDH1A1KDM4EMEN1KMT2ARAB9A | |
| SCHEMBL13462516 | 0.69 | ALDH1A1 (0.56) | SIGMAR1MGLLTSHRALDH1A1TP53 | |
| Propionaldehyde SCHEMBL27907303 | 0.67 | TP53 (0.46) | MGLLALDH1A1TP53RAB9ANPC1 | |
| Formic Acid SCHEMBL27266665 | 0.67 | BCL2 (0.47) | SIGMAR1MGLLTSHRALDH1A1TP53 | |
| SCHEMBL25465527 | 0.67 | ADRA2B (0.43) | SIGMAR1MGLLTSHRALDH1A1TP53 | |
| SCHEMBL19291460 | 0.67 | CHRNB2 (0.53) | SIGMAR1USP2TSHRNPSR1ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3774739-B1 | FUSED CYCLIC UREA DERIVATIVES AS CRHR2 ANTAGONIST | RAQUALIA PHARMA INC (JP) | 2022-05-11 | — | — | EP | disclosed |