Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TLR4 | O00206 | 2/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | PPARG | P37231 | 2/20 | 0.36 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.34 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.34 |
| ▸ | AR | P10275 | 1/20 | 0.34 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.34 |
| ▸ | S1PR2 | O95136 | 1/20 | 0.34 |
| ▸ | S1PR4 | O95977 | 1/20 | 0.34 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.34 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.34 |
| ▸ | S1PR5 | Q9H228 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL10385361 | 0.84 | CYP1A2 (0.43) | CYP1A2HTTSMN1; SMN2PPARGALOX5 | |
| SCHEMBL10385360 | 0.82 | CYP1A2 (0.42) | CYP1A2HTTSMN1; SMN2PPARGALOX5 | |
| SCHEMBL2690407 | 0.81 | CYP1A2 (0.47) | TLR4CYP1A2CYP19A1S1PR2S1PR4 | |
| SCHEMBL30931491 | 0.80 | CYP1A2 (0.50) | TLR4CYP1A2PPARGCYP19A1S1PR2 | |
| SCHEMBL8040250 | 0.80 | CYP1A2 (0.50) | TLR4CYP1A2PPARGCYP19A1S1PR2 | |
| SCHEMBL8025402 | 0.80 | CYP1A2 (0.50) | TLR4CYP1A2PPARGCYP19A1S1PR2 | |
| SCHEMBL2692573 | 0.80 | CYP1A2 (0.50) | TLR4CYP1A2PPARGCYP19A1S1PR2 | |
| SCHEMBL30931490 | 0.80 | CYP1A2 (0.50) | TLR4CYP1A2PPARGCYP19A1S1PR2 | |
| SCHEMBL30518306 | 0.80 | CYP1A2 (0.50) | TLR4CYP1A2PPARGCYP19A1S1PR2 | |
| SCHEMBL4741801 | 0.80 | CYP1A2 (0.50) | TLR4CYP1A2PPARGCYP19A1S1PR2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-102850200-B | A kind of method of suitability for industrialized production 4-hydroxy-cyclohexanone | XI'AN CAIJING OPTO-ELECTRICAL SCIENCE & TECHNOLOGY CO., LTD. (CN) | 2015-09-30 | — | — | CN | disclosed |