Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR7 | P34969 | 2/20 | 0.58 |
| ▸ | MYC | P01106 | 1/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | ACHE | P22303 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 1/20 | 0.38 |
| ▸ | CA2 | P00918 | 1/20 | 0.38 |
| ▸ | CA7 | P43166 | 1/20 | 0.38 |
| ▸ | CA9 | Q16790 | 1/20 | 0.38 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | NSD2 | O96028 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | HTR1A | P08908 | 4/20 | 0.37 |
| ▸ | HTR3A | P46098 | 4/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 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 | |
|---|---|---|---|---|
| SCHEMBL5887422 | 0.83 | HTR7 (0.42) | HTR7PDK2MAPTHTR1AHTR3A | |
| SCHEMBL3282090 | 0.81 | TSHR (0.43) | HTR7TSHRACHECA1CA2 | |
| SCHEMBL28899579 | 0.80 | MYC (0.58) | HTR7MYCTSHRACHECA1 | |
| SCHEMBL1133067 | 0.78 | MYC (0.56) | HTR7MYCTSHRACHECA1 | |
| SCHEMBL576578 | 0.76 | FABP4 (0.41) | HTR7MYCTSHRACHEKDM4E | |
| SCHEMBL576094 | 0.75 | ACHE (0.53) | TSHRACHECA1CA2CA7 | |
| SCHEMBL4469259 | 0.74 | MAPK1 (0.56) | HTR7TSHRKDM4ENSD2MAPT | |
| SCHEMBL22686100 | 0.73 | MYC (0.52) | HTR7MYCTSHRACHECA1 | |
| SCHEMBL2277338 | 0.72 | MYC (0.50) | HTR7MYCTSHRACHECA1 | |
| SCHEMBL15906499 | 0.72 | HTR1A (0.50) | TSHRACHECA1CA2CA7 |
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-7112697-B1 | Methods for formation of aryl-sulfur and aryl-selenium compounds using copper(I) catalysts | UNIVERSITY OF MASSACHUSETTS (US) | 2006-09-26 | — | — | US | disclosed |