Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 11/20 | 0.42 |
| ▸ | LMNA | P02545 | 5/20 | 0.42 |
| ▸ | HPGD | P15428 | 5/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.40 |
| ▸ | TSHR | P16473 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 3/20 | 0.39 |
| ▸ | HTT | P42858 | 2/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | RXFP1 | Q9HBX9 | 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 | |
|---|---|---|---|---|
| SCHEMBL19260372 | 0.86 | ALDH1A1 (0.53) | ALDH1A1LMNAHPGDKDM4ESMN1; SMN2 | |
| SCHEMBL19260403 | 0.83 | ALDH1A1 (0.39) | ALDH1A1LMNAHPGDHSD17B10KDM4E | |
| SCHEMBL19260400 | 0.83 | ALDH1A1 (0.46) | ALDH1A1LMNAHPGDHSD17B10KDM4E | |
| SCHEMBL19273934 | 0.82 | SMN1; SMN2 (0.47) | ALDH1A1HPGDHSD17B10KDM4ESMN1; SMN2 | |
| SCHEMBL28711406 | 0.80 | MAPT (0.38) | ALDH1A1LMNAHPGDKDM4ESMN1; SMN2 | |
| SCHEMBL18607017 | 0.75 | ALDH1A1 (0.39) | ALDH1A1 | |
| SCHEMBL23290005 | 0.73 | ALDH1A1 (0.37) | ALDH1A1LMNAHPGDSMN1; SMN2TP53 | |
| SCHEMBL23290004 | 0.73 | ALDH1A1 (0.37) | ALDH1A1LMNAHPGDSMN1; SMN2TP53 | |
| SCHEMBL23567424 | 0.71 | ALDH1A1 (0.36) | ALDH1A1LMNAHPGDKDM4ESMN1; SMN2 | |
| SCHEMBL28716442 | 0.70 | ALDH1A1 (0.36) | ALDH1A1LMNAHPGDKDM4ESMN1; SMN2 |
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-3416969-B1 | FUSED 1,4-OXAZEPINES AND RELATED ANALOGS AS BET BROMODOMAIN INHIBITORS | UNIV MICHIGAN REGENTS (US) | 2021-05-05 | — | — | EP | disclosed |