Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 7/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.52 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.52 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.51 |
| ▸ | HTT | P42858 | 2/20 | 0.48 |
| ▸ | THRB | P10828 | 1/20 | 0.47 |
| ▸ | HPGD | P15428 | 1/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 3/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.45 |
| ▸ | ESR1 | P03372 | 1/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.45 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.45 |
| ▸ | RNASEL | Q05823 | 1/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.44 |
| ▸ | TP53 | P04637 | 2/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL22700833 | 0.97 | TSHR (0.56) | TSHRALDH1A1CYP3A4TDP1HTT | |
| SCHEMBL4645535 | 0.93 | THRB (0.54) | TSHRALDH1A1CYP3A4TDP1HTT | |
| SCHEMBL434675 | 0.89 | TDP1 (0.68) | TSHRALDH1A1CYP3A4TDP1THRB | |
| SCHEMBL9723588 | 0.87 | ESR1 (0.61) | TSHRALDH1A1CYP3A4TDP1HPGD | |
| SCHEMBL29315934 | 0.86 | TDP1 (0.56) | TSHRALDH1A1CYP3A4TDP1THRB | |
| SCHEMBL4645538 | 0.86 | TSHR (0.57) | TSHRALDH1A1CYP3A4TDP1THRB | |
| SCHEMBL36483 | 0.86 | TDP1 (0.67) | TSHRALDH1A1CYP3A4TDP1HTT | |
| SCHEMBL222350 | 0.86 | HTT (0.65) | TSHRALDH1A1CYP3A4TDP1HTT | |
| SCHEMBL14597318 | 0.86 | TSHR (0.50) | TSHRALDH1A1CYP3A4TDP1HPGD | |
| SCHEMBL17036979 | 0.86 | THRB (0.58) | TSHRALDH1A1CYP3A4TDP1HTT |
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 |
|---|---|---|---|---|---|---|---|
| CN-104804382-B | The preparation method of the filling-modified Poly(Trimethylene Terephthalate) of a kind of negative ion | 福建师范大学泉港石化研究院 | 2016-06-15 | — | — | CN | claimed |
| CN-104804382-A | Preparation method of negative ion filled and modified PTT (polytrimethylene terephthalate) | QUANGANG PETROCHEMICAL RES INST FUJIAN NORMAL UNIV | 2015-07-29 | — | — | CN | claimed |
| CN-104804382-B | The preparation method of the filling-modified Poly(Trimethylene Terephthalate) of a kind of negative ion | 福建师范大学泉港石化研究院 | 2016-06-15 | — | — | CN | disclosed |
| CN-104804382-B | The preparation method of the filling-modified Poly(Trimethylene Terephthalate) of a kind of negative ion | 福建师范大学泉港石化研究院 | 2016-06-15 | — | — | CN | disclosed |
| CN-104804382-A | Preparation method of negative ion filled and modified PTT (polytrimethylene terephthalate) | QUANGANG PETROCHEMICAL RES INST FUJIAN NORMAL UNIV | 2015-07-29 | — | — | CN | disclosed |