Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 6/20 | 0.67 |
| ▸ | HPGD | P15428 | 1/20 | 0.67 |
| ▸ | THRB | P10828 | 4/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.51 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.51 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.51 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.51 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.51 |
| ▸ | ATM | Q13315 | 1/20 | 0.47 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.46 |
| ▸ | THRA | P10827 | 1/20 | 0.45 |
| ▸ | TP53 | P04637 | 1/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
| ▸ | LTA4H | P09960 | 4/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | CTSK | P43235 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| Benzene SCHEMBL25297827 | 0.87 | TSHR (0.88) | TSHRHPGDTHRBALDH1A1CYP3A4 | |
| Toluene SCHEMBL8766954 | 0.86 | TSHR (0.69) | TSHRHPGDTHRBALDH1A1CYP3A4 | |
| Phenol SCHEMBL28445734 | 0.86 | TSHR (0.69) | TSHRHPGDTHRBALDH1A1CYP3A4 | |
| Iodobenzene SCHEMBL28922112 | 0.86 | TSHR (0.69) | TSHRHPGDTHRBALDH1A1CYP3A4 | |
| Phenol SCHEMBL7901401 | 0.86 | TSHR (0.69) | TSHRHPGDTHRBALDH1A1CYP3A4 | |
| Benzene SCHEMBL28232511 | 0.85 | TSHR (0.85) | TSHRHPGDTHRBALDH1A1CYP3A4 | |
| Phthalic Acid SCHEMBL9652344 | 0.85 | TSHR (0.67) | TSHRHPGDTHRBALDH1A1CYP3A4 | |
| Styrene SCHEMBL3196230 | 0.85 | TSHR (0.67) | TSHRHPGDTHRBALDH1A1CYP3A4 | |
| Styrene SCHEMBL67823 | 0.85 | TSHR (0.67) | TSHRHPGDTHRBALDH1A1CYP3A4 | |
| SCHEMBL13372762 | 0.85 | TSHR (0.67) | TSHRHPGDTHRBALDH1A1CYP3A4 |
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 |
|---|---|---|---|---|---|---|---|
| CN-109836797-A | A kind of modified polyalcohol resin composite materials and preparation method thereof | 李娜 | 2019-06-04 | — | — | CN | disclosed |
| CN-109777124-A | A kind of modification dimethyl carbonate lotion of hydrolysis and preparation method thereof | 戴�峰 | 2019-05-21 | — | — | CN | disclosed |