Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 5/20 | 0.52 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.52 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.52 |
| ▸ | HTR2B | P41595 | 2/20 | 0.52 |
| ▸ | GABRA1 | P14867 | 2/20 | 0.52 |
| ▸ | GABRB2 | P47870 | 2/20 | 0.52 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.52 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.52 |
| ▸ | FAAH | O00519 | 1/20 | 0.52 |
| ▸ | CA1 | P00915 | 1/20 | 0.52 |
| ▸ | CA2 | P00918 | 1/20 | 0.52 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.52 |
| ▸ | HPGD | P15428 | 1/20 | 0.52 |
| ▸ | TSHR | P16473 | 1/20 | 0.52 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.52 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.52 |
| ▸ | HTR2C | P28335 | 1/20 | 0.52 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.52 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.52 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| Isothymol SCHEMBL11039381 | 0.84 | LMNA (0.63) | LMNACYP1A2SLC6A2HTR2BGABRA1 | |
| Isothymol SCHEMBL852892 | 0.84 | LMNA (0.68) | LMNACYP1A2SLC6A2HTR2BGABRA1 | |
| SCHEMBL30345339 | 0.84 | GABRA1 (0.73) | LMNACYP1A2SLC6A2HTR2BGABRA1 | |
| SCHEMBL99348 | 0.84 | GABRA1 (0.73) | LMNACYP1A2SLC6A2HTR2BGABRA1 | |
| P-Cymene SCHEMBL25285947 | 0.79 | GABRA1 (0.55) | LMNACYP1A2SLC6A2HTR2BGABRA1 | |
| Propofol SCHEMBL21412347 | 0.78 | GABRA1 (0.77) | LMNACYP1A2SLC6A2HTR2BGABRA1 | |
| Propofol SCHEMBL2683597 | 0.77 | LMNA (0.78) | LMNACYP1A2SLC6A2HTR2BGABRA1 | |
| Isothymol SCHEMBL27516545 | 0.77 | LMNA (0.59) | LMNASLC6A2HTR2BGABRA1GABRB2 | |
| SCHEMBL11878851 | 0.76 | LMNA (0.46) | LMNACYP1A2SLC6A2HTR2BGABRA1 | |
| Phenol SCHEMBL11288642 | 0.75 | GABRA1 (0.59) | LMNACYP1A2SLC6A2HTR2BGABRA1 |
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-3166691-A1 | ORAL AND DENTAL CARE AND CLEANING PRODUCTS WITH ACTIVE AGENT DEPOSITION | Henkel AG & Co. KGaA (DE) | 2017-05-17 | — | — | EP | disclosed |
| WO-2016005106-A1 | ORAL AND DENTAL CARE AND CLEANING PRODUCTS WITH ACTIVE AGENT DEPOSITION | HENKEL AG & CO. KGAA (DE) | 2016-01-14 | — | — | WO | disclosed |