Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRD4 | O60885 | 3/20 | 0.39 |
| ▸ | BRD2 | P25440 | 1/20 | 0.39 |
| ▸ | PTGS1 | P23219 | 5/20 | 0.38 |
| ▸ | PTGS2 | P35354 | 4/20 | 0.38 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 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 | |
|---|---|---|---|---|
| SCHEMBL27944218 | 0.84 | PDCD1 (0.41) | BRD4BRD2PTGS1PTGS2HSP90AB1 | |
| SCHEMBL27944216 | 0.81 | RAB9A (0.44) | SMN1; SMN2GAAALDH1A1MEN1KMT2A | |
| SCHEMBL27924771 | 0.80 | ALDH1A1 (0.38) | BRD4BRD2PTGS1PTGS2SMN1; SMN2 | |
| SCHEMBL9277637 | 0.79 | ERN1 (0.41) | BRD4BRD2PTGS1PTGS2ALDH1A1 | |
| SCHEMBL9975504 | 0.79 | ESR2 (0.41) | BRD4BRD2PTGS1PTGS2HSP90AB1 | |
| SCHEMBL9281485 | 0.72 | MAPT (0.43) | BRD4SMN1; SMN2GAAALDH1A1MEN1 | |
| SCHEMBL9283251 | 0.72 | BRD4 (0.44) | BRD4PTGS1PTGS2KMT2A | |
| SCHEMBL27924824 | 0.72 | BRD4 (0.37) | BRD4BRD2PTGS1PTGS2HSP90AB1 | |
| SCHEMBL27685077 | 0.71 | SMN1; SMN2 (0.43) | BRD4BRD2PTGS1PTGS2HSP90AB1 | |
| SCHEMBL13439166 | 0.71 | PTGS2 (0.48) | BRD4BRD2PTGS1PTGS2HSP90AB1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-103415525-B | Bromine domain inhibitor and uses thereof | CONSTELLATION PHARMACEUTICALS, INC. (US) | 2016-05-18 | — | — | CN | disclosed |