Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A2 | P23975 | 1/20 | 0.41 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.41 |
| ▸ | HTR1B | P28222 | 5/20 | 0.37 |
| ▸ | CA2 | P00918 | 3/20 | 0.35 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.35 |
| ▸ | CTNNB1 | P35222 | 3/20 | 0.34 |
| ▸ | WNT3A | P56704 | 3/20 | 0.34 |
| ▸ | DYRK1A | Q13627 | 4/20 | 0.33 |
| ▸ | CA12 | O43570 | 2/20 | 0.33 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.33 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.33 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.33 |
| ▸ | CDK9 | P50750 | 1/20 | 0.33 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL15069387 | 0.94 | SLC6A2 (0.43) | SLC6A2SLC6A4HTR1BCA2CYP2A6 | |
| SCHEMBL28064559 | 0.77 | CDK9 (0.36) | DYRK1ACDK9 | |
| SCHEMBL17656346 | 0.70 | SLC6A2 (0.48) | SLC6A2SLC6A4HTR1BCA2CYP2A6 | |
| SCHEMBL14777960 | 0.69 | GRIN1 (0.44) | — | |
| SCHEMBL2796940 | 0.67 | LOX (0.40) | CHRNA7 | |
| SCHEMBL10342511 | 0.66 | CYP2A6 (0.40) | CYP2A6 | |
| SCHEMBL24825898 | 0.66 | SLC6A4 (0.41) | SLC6A2SLC6A4HTR1BCYP2A6CTNNB1 | |
| SCHEMBL28064605 | 0.66 | SLC6A2 (0.40) | SLC6A2SLC6A4CA12 | |
| SCHEMBL14777801 | 0.65 | GRIN1 (0.44) | — | |
| SCHEMBL1602147 | 0.65 | HTR1D (0.40) | SLC6A2SLC6A4HTR1BCYP2A6CTNNB1 |
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-105658628-A | Novel arylalkene derivatives and use thereof as selective estrogen receptor modulators | 北京赛林泰医药技术有限公司 | 2016-06-08 | — | — | CN | disclosed |