Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | ESR1 | P03372 | 1/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.47 |
| ▸ | RNASEL | Q05823 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | NR5A1 | Q13285 | 1/20 | 0.47 |
| ▸ | LTA4H | P09960 | 2/20 | 0.45 |
| ▸ | CA1 | P00915 | 2/20 | 0.43 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.43 |
| ▸ | HSD17B3 | P37058 | 6/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | XBP1 | P17861 | 1/20 | 0.42 |
| ▸ | ATM | Q13315 | 1/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 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 | |
|---|---|---|---|---|
| SCHEMBL6913900 | 0.98 | NR5A1 (0.50) | LMNAESR1CYP1A2CYP2D6TSHR | |
| SCHEMBL6938745 | 0.98 | NR5A1 (0.50) | LMNAESR1CYP1A2CYP2D6TSHR | |
| SCHEMBL22500350 | 0.95 | ESR1 (0.49) | LMNAESR1CYP1A2CYP2D6TSHR | |
| SCHEMBL6931958 | 0.91 | LMNA (0.54) | LMNAESR1CYP1A2CYP2D6TSHR | |
| SCHEMBL20138640 | 0.89 | ESR1 (0.44) | LMNAESR1CYP1A2CYP2D6TSHR | |
| SCHEMBL20222952 | 0.86 | LMNA (0.49) | LMNACYP1A2CYP2D6TSHRCYP2C19 | |
| SCHEMBL15546907 | 0.86 | ELANE (0.46) | LMNACA1PRSS1PRSS2PRSS3 | |
| SCHEMBL2291004 | 0.86 | PRSS1 (0.48) | TSHRMAPK1CA1ATML3MBTL1 | |
| SCHEMBL28129972 | 0.85 | GAA (0.50) | NR5A1CA1TRPV1GAAXBP1 | |
| SCHEMBL22471847 | 0.85 | GAA (0.50) | NR5A1CA1TRPV1GAAXBP1 |
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-106588643-A | Tetrabromobisphenol A derivative TBBPA-DBPE hapten and synthesis method and application thereof | 江苏大学 | 2017-04-26 | — | — | CN | disclosed |