Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.44 |
| ▸ | PARP1 | P09874 | 1/20 | 0.40 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.40 |
| ▸ | TYMS | P04818 | 2/20 | 0.38 |
| ▸ | APP | P05067 | 1/20 | 0.35 |
| ▸ | BACE1 | P56817 | 1/20 | 0.35 |
| ▸ | CCNB2 | O95067 | 1/20 | 0.35 |
| ▸ | CDK1 | P06493 | 1/20 | 0.35 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.35 |
| ▸ | CCNB3 | Q8WWL7 | 1/20 | 0.35 |
| ▸ | S100A4 | P26447 | 1/20 | 0.34 |
| ▸ | METAP1 | P53582 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | PNMT | P11086 | 1/20 | 0.33 |
| ▸ | ASIC3 | Q9UHC3 | 1/20 | 0.33 |
| ▸ | HTR2A | P28223 | 1/20 | 0.32 |
| ▸ | HTR2C | P28335 | 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 | |
|---|---|---|---|---|
| SCHEMBL14958183 | 0.76 | TDP1 (0.41) | TDP1L3MBTL1PARP1PARP10TYMS | |
| SCHEMBL14958358 | 0.76 | TDP1 (0.41) | TDP1L3MBTL1PARP1PARP10TYMS | |
| SCHEMBL14059227 | 0.74 | TDP1 (0.43) | TDP1L3MBTL1PARP1PARP10TYMS | |
| SCHEMBL30643139 | 0.74 | METAP1 (0.46) | TDP1L3MBTL1PARP1PARP10TYMS | |
| SCHEMBL6209711 | 0.74 | METAP1 (0.46) | TDP1L3MBTL1PARP1PARP10TYMS | |
| SCHEMBL14059697 | 0.72 | METAP1 (0.57) | TDP1L3MBTL1PARP1PARP10TYMS | |
| SCHEMBL14059228 | 0.71 | SLC6A3 (0.40) | TDP1L3MBTL1PARP1PARP10 | |
| SCHEMBL23264456 | 0.71 | L3MBTL1 (0.62) | TDP1L3MBTL1PARP1PARP10CCNB2 | |
| SCHEMBL9948229 | 0.71 | PARP10 (0.44) | TDP1L3MBTL1PARP1PARP10TYMS | |
| SCHEMBL29483386 | 0.71 | MAOA (0.53) | TDP1L3MBTL1PARP1PARP10TYMS |
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 |
|---|---|---|---|---|---|---|---|
| WO-2012162330-A1 | TRICYCLIC COMPOUNDS AS INHIBITORS FOR THE PRODUCTION OF BETA-AMYLOID | BRISTOL-MYERS SQUIBB COMPANY (US) | 2012-11-29 | — | — | WO | disclosed |