Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRD4 | O60885 | 1/20 | 0.35 |
| ▸ | BRD2 | P25440 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL27762482 | 0.90 | BRD4 (0.34) | BRD4BRD2 | |
| SCHEMBL2858747 | 0.88 | BRD4 (0.38) | BRD4BRD2LMNA | |
| SCHEMBL12443433 | 0.84 | KDM4E (0.31) | — | |
| SCHEMBL1974003 | 0.82 | KDM4E (0.33) | BRD4BRD2 | |
| SCHEMBL442676 | 0.73 | BRD4 (0.44) | BRD4BRD2LMNA | |
| SCHEMBL8769306 | 0.72 | — | — | |
| SCHEMBL600282 | 0.72 | BRD4 (0.52) | BRD4BRD2LMNA | |
| SCHEMBL2529557 | 0.72 | HTR2C (0.34) | BRD4BRD2 | |
| SCHEMBL2997559 | 0.72 | BRD4 (0.42) | BRD4BRD2LMNA | |
| SCHEMBL146124 | 0.71 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-101514205-A | 7a-(difluoromethyl)tetrahydro-1H-pyrrolo[1,2-alpha]imidazole-5(6H)-ketone and synthetic method thereof | UNIV SHANGHAI SCIENCE & TECH (CN) | 2009-08-26 | — | — | CN | disclosed |
| CN-101514204-A | 7a-(trifluoromethyl)tetrahydro-1H-pyrrolo[1,2-a]imidazole-5(6H)-ketone and synthetic method thereof | UNIV SHANGHAI SCIENCE & TECH (CN) | 2009-08-26 | — | — | CN | disclosed |