Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAP2 | P11137 | 3/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | HTT | P42858 | 2/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | TYMP | P19971 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | METAP2 | P50579 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 2/20 | 0.39 |
| ▸ | CA2 | P00918 | 2/20 | 0.39 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.39 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.39 |
| ▸ | LCK | P06239 | 1/20 | 0.39 |
| ▸ | CSF1R | P07333 | 1/20 | 0.39 |
| ▸ | PIM1 | P11309 | 1/20 | 0.39 |
| ▸ | RPS6KB1 | P23443 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL34468297 | 0.87 | MAP2 (0.45) | MAP2CYP1A2GRM2METAP2 | |
| SCHEMBL23174839 | 0.82 | TYMP (0.42) | MAP2CYP1A2HTTTYMPLMNA | |
| SCHEMBL16887400 | 0.82 | AKR1C2 (0.48) | MAP2HTTTYMPLMNAMAPT | |
| SCHEMBL778763 | 0.78 | DHODH (0.46) | HTTTSHRTYMPLMNAMAPT | |
| SCHEMBL26633297 | 0.78 | MAOA (0.44) | MAP2CYP1A2HTTTSHRTYMP | |
| SCHEMBL23579224 | 0.78 | L3MBTL1 (0.45) | HTTTSHRLMNAMAPTL3MBTL1 | |
| SCHEMBL4128649 | 0.76 | TYMP (0.38) | MAP2HTTTYMPLMNAMAPT | |
| SCHEMBL24723198 | 0.76 | RPS6KA3 (0.47) | HTTTYMPLMNAMAPTMAPK1 | |
| SCHEMBL4135757 | 0.76 | MAPT (0.42) | MAP2HTTTYMPLMNAMAPT | |
| SCHEMBL28086881 | 0.76 | ESR1 (0.52) | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5540838-A | Stimulation of microbial para-dechlorination of polychlorinated biphenyls | GENERAL ELECTRIC COMPANY (US) | 1996-07-30 | — | — | US | claimed |
| WO-2021040467-A1 | NOVEL HETEROCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE USING SAME | 주식회사 엘지화학 | 2021-03-04 | — | — | WO | disclosed |
| US-5540838-A | Stimulation of microbial para-dechlorination of polychlorinated biphenyls | GENERAL ELECTRIC COMPANY (US) | 1996-07-30 | — | — | US | disclosed |
| US-5540838-A | Stimulation of microbial para-dechlorination of polychlorinated biphenyls | GENERAL ELECTRIC COMPANY (US) | 1996-07-30 | — | — | US | disclosed |