Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KIF11 | P52732 | 8/20 | 0.40 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.39 |
| ▸ | PNMT | P11086 | 1/20 | 0.37 |
| ▸ | SCN5A | Q14524 | 3/20 | 0.36 |
| ▸ | SCN9A | Q15858 | 3/20 | 0.36 |
| ▸ | CASR | P41180 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.33 |
| ▸ | HTR2A | P28223 | 1/20 | 0.33 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.33 |
| ▸ | HRH1 | P35367 | 1/20 | 0.33 |
| ▸ | HTR2B | P41595 | 1/20 | 0.33 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.33 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.33 |
| ▸ | PKM | P14618 | 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 | |
|---|---|---|---|---|
| SCHEMBL8717072 | 0.90 | KIF11 (0.40) | KIF11PNMTSCN5ASCN9ACASR | |
| SCHEMBL8713872 | 0.90 | ESR1 (0.42) | KIF11PNMTCASRSLC6A2PKM | |
| SCHEMBL8714910 | 0.88 | KIF11 (0.43) | KIF11PNMT | |
| SCHEMBL8716720 | 0.86 | CASR (0.49) | KIF11CASRSLC6A4 | |
| SCHEMBL8714176 | 0.85 | MAOB (0.43) | KIF11SCN5ASCN9ACYP3A4CYP1A2 | |
| SCHEMBL8713560 | 0.85 | KIF11 (0.42) | KIF11SCN5ASCN9ACYP3A4CYP1A2 | |
| SCHEMBL8714644 | 0.85 | KIF11 (0.44) | KIF11ADRB1PKM | |
| SCHEMBL8713802 | 0.84 | KIF11 (0.44) | KIF11ADRB1CYP3A4CYP1A2CYP2D6 | |
| SCHEMBL8713306 | 0.84 | KIF11 (0.40) | KIF11PNMTSCN5ASCN9APKM | |
| SCHEMBL8714279 | 0.83 | KIF11 (0.40) | KIF11SCN5ASCN9ACYP3A4CYP1A2 |
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 |
|---|---|---|---|---|---|---|---|
| US-5811293-A | CULTURE PRODUCT AS CHEMICAL INTERMEDIATE FOR ANTI-OBESITY AGENT | DAICEL CHEMICAL INDUSTRIES, LTD. (JP) | 1998-09-22 | — | — | US | disclosed |