Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1B1 | P15121 | 2/20 | 0.51 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.48 |
| ▸ | ACHE | P22303 | 1/20 | 0.40 |
| ▸ | MAOA | P21397 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | S100A4 | P26447 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.34 |
| ▸ | LMNA | P02545 | 2/20 | 0.34 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.34 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.34 |
| ▸ | DRD2 | P14416 | 1/20 | 0.34 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.34 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.34 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.34 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.34 |
| ▸ | HTR2A | P28223 | 1/20 | 0.34 |
| ▸ | HTR2C | P28335 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL11820011 | 0.82 | AKR1B1 (0.51) | AKR1B1MAPK14ACHEMAOATP53 | |
| SCHEMBL11840294 | 0.82 | AKR1B1 (0.57) | AKR1B1MAPK14ACHEMAOATP53 | |
| SCHEMBL11334878 | 0.81 | AKR1B1 (0.59) | AKR1B1MAPK14TP53MAPTLMNA | |
| SCHEMBL11754943 | 0.80 | AKR1B1 (0.55) | AKR1B1MAPK14ACHEMAOATP53 | |
| SCHEMBL11664130 | 0.80 | AKR1B1 (0.49) | AKR1B1MAPK14ACHEMAOATP53 | |
| SCHEMBL11760187 | 0.80 | AKR1B1 (0.55) | AKR1B1MAPK14ACHEMAOATP53 | |
| SCHEMBL11848142 | 0.78 | AKR1B1 (0.50) | AKR1B1MAPK14ACHEMAOATP53 | |
| SCHEMBL11654838 | 0.78 | AKR1B1 (0.47) | AKR1B1MAPK14ACHEMAOATP53 | |
| SCHEMBL11711522 | 0.77 | AKR1B1 (0.56) | AKR1B1MAPK14ACHEMAOAMAPT | |
| SCHEMBL11846414 | 0.76 | AKR1B1 (0.54) | AKR1B1MAPK14ACHETP53MAPT |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4066663-A | 6,11-Dihydrodibenzo-[b. e.]-thiepin-11-one-3-aldehyde and 3-acetal derivatives | SYNTEX (U.S.A.) INC. (US) | 1978-01-03 | — | — | US | claimed |
| US-4066663-A | 6,11-Dihydrodibenzo-[b. e.]-thiepin-11-one-3-aldehyde and 3-acetal derivatives | SYNTEX (U.S.A.) INC. (US) | 1978-01-03 | — | — | US | disclosed |
| US-4066663-A | 6,11-Dihydrodibenzo-[b. e.]-thiepin-11-one-3-aldehyde and 3-acetal derivatives | SYNTEX (U.S.A.) INC. (US) | 1978-01-03 | — | — | US | disclosed |