Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.41 |
| ▸ | KCNN4 | O15554 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 3/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | BCHE | P06276 | 2/20 | 0.38 |
| ▸ | ACHE | P22303 | 2/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.37 |
| ▸ | KIF11 | P52732 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| Tert-Butylbenzene SCHEMBL28018291 | 0.89 | BCHE (0.41) | TAAR1KCNN4MAPK1TSHRALDH1A1 | |
| Tert-Butylbenzene SCHEMBL28464198 | 0.83 | TSHR (0.53) | TAAR1KCNN4MAPK1TSHRALDH1A1 | |
| Tert-Butylbenzene SCHEMBL27713888 | 0.83 | TSHR (0.53) | TAAR1KCNN4MAPK1TSHRALDH1A1 | |
| Tert-Butylbenzene SCHEMBL337648 | 0.80 | MAPK1 (0.55) | TAAR1KCNN4MAPK1TSHRALDH1A1 | |
| Tert-Butylbenzene SCHEMBL22264597 | 0.80 | MAPK1 (0.55) | TAAR1KCNN4MAPK1TSHRALDH1A1 | |
| Tert-Butylbenzene SCHEMBL2568053 | 0.80 | MAPK1 (0.55) | TAAR1KCNN4MAPK1TSHRALDH1A1 | |
| Tert-Butylbenzene SCHEMBL18889 | 0.80 | MAPK1 (0.55) | TAAR1KCNN4MAPK1TSHRALDH1A1 | |
| Tert-Butylbenzene SCHEMBL22264599 | 0.80 | MAPK1 (0.55) | TAAR1KCNN4MAPK1TSHRALDH1A1 | |
| Tert-Butylbenzene SCHEMBL10411186 | 0.78 | CYP2C19 (0.46) | TAAR1KCNN4MAPK1TSHRALDH1A1 | |
| Tert-Butylbenzene SCHEMBL28319362 | 0.78 | TAAR1 (0.46) | TAAR1KCNN4MAPK1TSHRALDH1A1 |
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-104725667-A | Novel phosphorus and silicon flame retardant with double caged phosphate structure as well as preparation method and application of novel flame retardant | UNIV CHINA THREE GORGES CTGU | 2015-06-24 | — | — | CN | claimed |
| CN-104725667-A | Novel phosphorus and silicon flame retardant with double caged phosphate structure as well as preparation method and application of novel flame retardant | UNIV CHINA THREE GORGES CTGU | 2015-06-24 | — | — | CN | disclosed |
| CN-104647754-A | Three-dimensional shaped object, three-dimensional shaped object manufacturing method and apparatus, method of controlling three-dimensional shaped object manufacturing apparatus, and program for controlling three-dimensional shaped object manufacturing apparatus | SEIKO EPSON CORP | 2015-05-27 | — | — | CN | disclosed |