Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A3 | Q01959 | 6/20 | 0.46 |
| ▸ | SLC6A2 | P23975 | 5/20 | 0.46 |
| ▸ | CHRNA1 | P02708 | 1/20 | 0.46 |
| ▸ | CHRNG | P07510 | 1/20 | 0.46 |
| ▸ | CHRNB1 | P11230 | 1/20 | 0.46 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.46 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.46 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.46 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.46 |
| ▸ | CHRND | Q07001 | 1/20 | 0.46 |
| ▸ | SLC6A4 | P31645 | 5/20 | 0.40 |
| ▸ | HCAR3 | P49019 | 1/20 | 0.36 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.36 |
| ▸ | CCR2 | P41597 | 1/20 | 0.35 |
| ▸ | REN | P00797 | 4/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.33 |
| ▸ | KCNH2 | Q12809 | 4/20 | 0.33 |
| ▸ | CES2 | O00748 | 1/20 | 0.33 |
| ▸ | CES1 | P23141 | 1/20 | 0.33 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL14244552 | 0.76 | SLC6A3 (0.40) | SLC6A3SLC6A2CHRNA1CHRNGCHRNB1 | |
| SCHEMBL9230201 | 0.76 | SLC6A3 (0.40) | SLC6A3SLC6A2CHRNA1CHRNGCHRNB1 | |
| SCHEMBL18673677 | 0.74 | SLC6A3 (0.46) | SLC6A3SLC6A2CHRNA1CHRNGCHRNB1 | |
| SCHEMBL23215170 | 0.72 | SLC6A3 (0.47) | SLC6A3SLC6A2CHRNA1CHRNGCHRNB1 | |
| SCHEMBL23231379 | 0.72 | SLC6A3 (0.46) | SLC6A3SLC6A2CHRNA1CHRNGCHRNB1 | |
| SCHEMBL9224799 | 0.72 | SLC6A3 (0.37) | SLC6A3SLC6A2CHRNA1CHRNGCHRNB1 | |
| SCHEMBL6253537 | 0.72 | HDAC1 (0.42) | SLC6A3SLC6A2CHRNB2CHRNB4CHRNA3 | |
| SCHEMBL1446220 | 0.69 | SLC6A3 (0.51) | SLC6A3SLC6A2CHRNA1CHRNGCHRNB1 | |
| SCHEMBL17186929 | 0.69 | SLC6A3 (0.49) | SLC6A3SLC6A2CHRNA1CHRNGCHRNB1 | |
| SCHEMBL1720045 | 0.69 | SLC6A3 (0.41) | SLC6A3SLC6A2CHRNA1CHRNGCHRNB1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0634413-A1 | Herbicides | RHONE POULENC AGRICULTURE LTD. (GB) | 1995-01-18 | — | — | EP | disclosed |
| US-4344960-A | Combating insects and acarids with 3-(2-chloro-3,3,4,4,4-pentafluoro-1-butenyl)-2,2-dimethyl-cyclopropanecarboxylic acid esters | BAYER AKTIENGESELLSCHAFT (DE) | 1982-08-17 | — | — | US | disclosed |