Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 4/20 | 0.39 |
| ▸ | DRD2 | P14416 | 1/20 | 0.39 |
| ▸ | DRD4 | P21917 | 1/20 | 0.39 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.39 |
| ▸ | DRD3 | P35462 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.37 |
| ▸ | ATM | Q13315 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.35 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.35 |
| ▸ | ESR1 | P03372 | 2/20 | 0.34 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.34 |
| ▸ | KCNN4 | O15554 | 2/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | CHRM3 | P20309 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 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 | |
|---|---|---|---|---|
| SCHEMBL28062274 | 0.81 | MAPK1 (0.37) | MAPK1CYP3A4ALDH1A1TAAR1ALOX15 | |
| SCHEMBL10229439 | 0.81 | CYP2D6 (0.38) | CYP2D6DRD2DRD4OPRM1DRD3 | |
| SCHEMBL9165033 | 0.81 | CYP2D6 (0.38) | CYP2D6DRD2DRD4OPRM1DRD3 | |
| SCHEMBL8104987 | 0.80 | CYP2C19 (0.43) | CYP2D6DRD2DRD4OPRM1DRD3 | |
| SCHEMBL8104983 | 0.80 | CYP2C19 (0.43) | CYP2D6DRD2DRD4OPRM1DRD3 | |
| SCHEMBL7030622 | 0.74 | MAPK1 (0.46) | CYP2D6DRD2DRD4OPRM1DRD3 | |
| SCHEMBL4410908 | 0.74 | L3MBTL1 (0.38) | TSHR | |
| SCHEMBL200565 | 0.73 | ALDH1A1 (0.43) | CYP2D6DRD2DRD4OPRM1DRD3 | |
| SCHEMBL27390196 | 0.73 | ALDH1A1 (0.43) | CYP2D6DRD2DRD4OPRM1DRD3 | |
| SCHEMBL3995663 | 0.73 | ALDH1A1 (0.43) | CYP2D6DRD2DRD4OPRM1DRD3 |
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 |
|---|---|---|---|---|---|---|---|
| CN-101065473-B | Detergent compositions | PROCTER & GAMBLE | 2012-01-18 | — | — | CN | disclosed |
| CN-101065473-A | Detergent compositions | PROCTER & GAMBLE (US) | 2007-10-31 | — | — | CN | disclosed |
| EP-1055653-A2 | Process for the preparation of alkenyl compounds | BASF AKTIENGESELLSCHAFT (DE) | 2000-11-29 | — | — | EP | disclosed |