Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.40 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.40 |
| ▸ | CYSLTR2 | Q9NS75 | 6/20 | 0.40 |
| ▸ | CYSLTR1 | Q9Y271 | 6/20 | 0.40 |
| ▸ | GABRA1 | P14867 | 2/20 | 0.37 |
| ▸ | GABRB2 | P47870 | 2/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.35 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.35 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.35 |
| ▸ | MGLL | Q99685 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | SLC6A2 | P23975 | 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 | |
|---|---|---|---|---|
| SCHEMBL6682017 | 0.88 | CYSLTR2 (0.41) | TSHRSMN1; SMN2TAS1R3TAS1R1CYSLTR2 | |
| SCHEMBL6682255 | 0.86 | CYSLTR2 (0.43) | TSHRCYSLTR2CYSLTR1NPSR1 | |
| SCHEMBL6679577 | 0.85 | CYSLTR2 (0.46) | CYSLTR2CYSLTR1NPSR1 | |
| SCHEMBL31380293 | 0.84 | TSHR (0.48) | TSHRSMN1; SMN2CYSLTR2CYSLTR1GABRA1 | |
| SCHEMBL21499442 | 0.84 | TSHR (0.38) | TSHRSMN1; SMN2TAS1R3TAS1R1CYSLTR2 | |
| SCHEMBL27658986 | 0.84 | TSHR (0.38) | TSHRSMN1; SMN2TAS1R3TAS1R1CYSLTR2 | |
| SCHEMBL3627333 | 0.83 | TSHR (0.59) | TSHRGABRA1GABRB2MAPTNPSR1 | |
| SCHEMBL6546794 | 0.82 | ALDH1A1 (0.46) | TSHRSMN1; SMN2POLBHTTCYP2D6 | |
| SCHEMBL19013294 | 0.81 | CYSLTR2 (0.47) | TSHRSMN1; SMN2TAS1R3TAS1R1CYSLTR2 | |
| SCHEMBL2697157 | 0.81 | TSHR (0.42) | TSHRSMN1; SMN2CYSLTR2CYSLTR1GABRA1 |
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 |
|---|---|---|---|---|---|---|---|
| US-5136089-A | ACYLATION OF ALKYL AROMATIC HYDROCARBONS | BASF AKTIENGESELLSCHAFT (DE) | 1992-08-04 | — | — | US | disclosed |