Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOA | P21397 | 2/20 | 0.39 |
| ▸ | MAOB | P27338 | 2/20 | 0.39 |
| ▸ | KDM1A | O60341 | 1/20 | 0.39 |
| ▸ | SLC6A4 | P31645 | 4/20 | 0.37 |
| ▸ | SLC6A3 | Q01959 | 4/20 | 0.37 |
| ▸ | CHRNA1 | P02708 | 2/20 | 0.37 |
| ▸ | CHRNG | P07510 | 2/20 | 0.37 |
| ▸ | CHRNB1 | P11230 | 2/20 | 0.37 |
| ▸ | CHRNB2 | P17787 | 2/20 | 0.37 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.37 |
| ▸ | CHRNB4 | P30926 | 2/20 | 0.37 |
| ▸ | CHRNA3 | P32297 | 2/20 | 0.37 |
| ▸ | CHRNA4 | P43681 | 2/20 | 0.37 |
| ▸ | CHRND | Q07001 | 2/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.33 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.33 |
| ▸ | DRD2 | P14416 | 1/20 | 0.33 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.33 |
| ▸ | CPT1A | P50416 | 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 | |
|---|---|---|---|---|
| SCHEMBL2173955 | 0.81 | SLC6A3 (0.38) | MAOAMAOBSLC6A4SLC6A3CHRNA1 | |
| SCHEMBL9661723 | 0.79 | SLC6A4 (0.40) | MAOAMAOBKDM1ASLC6A4SLC6A3 | |
| SCHEMBL9560864 | 0.79 | TAAR1 (0.36) | CYP2A6SMN1; SMN2HSD11B1 | |
| SCHEMBL901820 | 0.79 | CHRNA1 (0.36) | SLC6A3CHRNA1CHRNGCHRNB1CHRNB2 | |
| SCHEMBL9561216 | 0.79 | MAOB (0.39) | MAOAMAOBSLC6A4SLC6A3CHRNA1 | |
| SCHEMBL20087810 | 0.78 | MAOB (0.38) | MAOAMAOBSLC6A3CHRNB2SLC6A2 | |
| SCHEMBL9560600 | 0.76 | NPC1 (0.40) | MAOAMAOBKDM1ALMNAPDK2 | |
| SCHEMBL9861827 | 0.75 | SLC6A4 (0.44) | KDM1ASLC6A4SLC6A3SLC6A2 | |
| Chlorobenzene SCHEMBL10966436 | 0.73 | TSHR (0.39) | KDM1ASLC6A4SLC6A3CHRNA1CHRNG | |
| SCHEMBL9561250 | 0.71 | NQO1 (0.47) | LMNAPDK2 |
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-5225607-A | Multistage etherification or dehydrohalogenation and reductive dechlorination | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1993-07-06 | — | — | US | disclosed |
| US-5196610-A | INSECTICIDAL ETHERS | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1993-03-23 | — | — | US | disclosed |
| EP-0211561-B1 | INSECTICIDAL ETHERS | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1992-03-11 | — | — | EP | disclosed |
| EP-0211561-A1 | Insecticidal ethers | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1987-02-25 | — | — | EP | disclosed |