Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR7 | P34969 | 5/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.51 |
| ▸ | LMNA | P02545 | 2/20 | 0.51 |
| ▸ | GAA | P10253 | 1/20 | 0.51 |
| ▸ | PTPRC | P08575 | 1/20 | 0.51 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.51 |
| ▸ | ERN1 | O75460 | 1/20 | 0.50 |
| ▸ | NPC1 | O15118 | 1/20 | 0.49 |
| ▸ | TP53 | P04637 | 1/20 | 0.49 |
| ▸ | RAB9A | P51151 | 1/20 | 0.49 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.49 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.48 |
| ▸ | CYP2E1 | P05181 | 1/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.48 |
| ▸ | CYP2C8 | P10632 | 1/20 | 0.48 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.48 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL28102075 | 1.00 | HTR7 (0.51) | HTR7ALDH1A1SMN1; SMN2KDM4ELMNA | |
| SCHEMBL3743489 | 0.91 | PTPRC (0.58) | HTR7ALDH1A1SMN1; SMN2KDM4ELMNA | |
| Biphenyl SCHEMBL9989359 | 0.89 | ALDH1A1 (0.56) | HTR7ALDH1A1SMN1; SMN2KDM4ELMNA | |
| SCHEMBL29629017 | 0.87 | HTR7 (0.64) | HTR7ALDH1A1SMN1; SMN2KDM4ELMNA | |
| SCHEMBL26556078 | 0.87 | HTR7 (0.64) | HTR7ALDH1A1SMN1; SMN2KDM4ELMNA | |
| SCHEMBL24106783 | 0.87 | ALDH1A1 (0.55) | HTR7ALDH1A1SMN1; SMN2KDM4ELMNA | |
| SCHEMBL294721 | 0.87 | ALDH1A1 (0.58) | HTR7ALDH1A1SMN1; SMN2KDM4ELMNA | |
| SCHEMBL30136447 | 0.87 | ALDH1A1 (0.58) | HTR7ALDH1A1SMN1; SMN2KDM4ELMNA | |
| SCHEMBL30017788 | 0.85 | ALDH1A1 (0.56) | HTR7ALDH1A1SMN1; SMN2KDM4ELMNA | |
| SCHEMBL20022118 | 0.83 | ALDH1A1 (0.57) | HTR7ALDH1A1SMN1; SMN2PTPRCPTPN1 |
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-105037072-A | Synthetic method for 1,3,5-triarylbenzene compound | UNIV HUAQIAO | 2015-11-11 | — | — | CN | disclosed |