Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PPARG | P37231 | 12/20 | 0.46 |
| ▸ | PPARA | Q07869 | 10/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.41 |
| ▸ | SLC6A2 | P23975 | 3/20 | 0.41 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.41 |
| ▸ | TSHR | P16473 | 2/20 | 0.41 |
| ▸ | ADRA2B | P18089 | 2/20 | 0.41 |
| ▸ | HTR2A | P28223 | 2/20 | 0.41 |
| ▸ | HTR2C | P28335 | 2/20 | 0.41 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.41 |
| ▸ | HRH1 | P35367 | 2/20 | 0.41 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.41 |
| ▸ | DRD3 | P35462 | 2/20 | 0.41 |
| ▸ | OPRK1 | P41145 | 2/20 | 0.41 |
| ▸ | HTR2B | P41595 | 2/20 | 0.41 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.41 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL14565994 | 0.85 | CTRC (0.50) | PPARGPPARATDP1CYP3A4OPRK1 | |
| SCHEMBL5718636 | 0.85 | KMT2A (0.55) | PPARGPPARACYP1A2CYP3A4CYP2D6 | |
| SCHEMBL3978158 | 0.83 | PPARG (0.47) | PPARGPPARATDP1CYP1A2CYP3A4 | |
| SCHEMBL8935641 | 0.81 | SMN1; SMN2 (0.57) | PPARGPPARATDP1TSHRKDM4E | |
| SCHEMBL3879629 | 0.81 | SMN1; SMN2 (0.57) | PPARGPPARATDP1TSHRKDM4E | |
| SCHEMBL9623318 | 0.77 | TDP1 (0.49) | PPARGPPARATDP1KMT2APTGES | |
| SCHEMBL8563940 | 0.76 | PPARG (0.46) | PPARGPPARA | |
| SCHEMBL8563944 | 0.76 | PPARG (0.46) | PPARGPPARA | |
| SCHEMBL28490552 | 0.75 | PPARG (0.49) | PPARGPPARATDP1PTGESALOX5 | |
| SCHEMBL30639267 | 0.75 | CTRC (0.54) | PPARGPPARACYP3A4OPRK1HTR2B |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4310512-A | Derivatives of acetic and propionic acids, compositions containing same and use as malodor counteractants | BUSH BOAKE ALLEN INC. (US) | 1982-01-12 | — | — | US | claimed |
| EP-1167507-B1 | Malodor counteractant compositions and methods for preparing and using same | BUSH BOAKE ALLEN INC (US) | 2007-10-10 | — | — | EP | disclosed |
| US-6432891-B1 | INTRODUCING INTO SOLID OR LIQUID, SOAP OR DETERGENT COMPOUND SELECTED FROM 1-CYCLOHEXYL-ETHYLBUTYRATE, 1-CYCLOHEXYL-ETHYLACETATE, 1-CYCLOHEXYL-ETHANOL, 4-ISOPROPYL-CYCLOHEXYLPROPIONATE | BUSH BOAKE ALLEN INC., | 2002-08-13 | — | — | US | disclosed |
| US-20020032131-A1 | Malodor counteractant compositions and methods for preparing and using same | BUSH BOAKE ALLEN INC. | 2002-03-14 | — | — | US | disclosed |
| EP-1167507-A2 | Malodor counteractant compositions and methods for preparing and using same | Bush Boake Allen Inc. (US) | 2002-01-02 | — | — | EP | disclosed |