Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.36 |
| ▸ | CHRNB2 | P17787 | 8/20 | 0.33 |
| ▸ | CHRNA4 | P43681 | 8/20 | 0.33 |
| ▸ | CHRNB4 | P30926 | 3/20 | 0.33 |
| ▸ | CHRNA3 | P32297 | 3/20 | 0.33 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | SMYD3 | Q9H7B4 | 1/20 | 0.32 |
| ▸ | PTK2 | Q05397 | 1/20 | 0.32 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 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 | |
|---|---|---|---|---|
| SCHEMBL1426303 | 0.76 | POLB (0.38) | POLBHCAR2CHRNB2CHRNA4CHRNB4 | |
| SCHEMBL29845299 | 0.76 | POLB (0.38) | POLBHCAR2CHRNB2CHRNA4CHRNB4 | |
| SCHEMBL13073608 | 0.74 | CYP2A6 (0.31) | POLBHCAR2CYP2A6 | |
| SCHEMBL744158 | 0.72 | TSHR (0.37) | POLBHCAR2CHRNB2CHRNA4CHRNB4 | |
| SCHEMBL31014511 | 0.72 | CYP11B2 (0.46) | POLBHCAR2CHRNB2CHRNA4KDM4E | |
| SCHEMBL15463774 | 0.71 | CYP11B2 (0.36) | POLBHCAR2CHRNB2CHRNA4CHRNB4 | |
| SCHEMBL30132809 | 0.71 | CYP11B1 (0.43) | POLBHCAR2CHRNB2CHRNA4CHRNB4 | |
| SCHEMBL1356433 | 0.71 | CYP11B1 (0.43) | POLBHCAR2CHRNB2CHRNA4CHRNB4 | |
| SCHEMBL20242412 | 0.70 | CHRNB2 (0.32) | POLBHCAR2CHRNB2CHRNA4CHRNB4 | |
| SCHEMBL748571 | 0.69 | CHRNB2 (0.34) | POLBHCAR2CHRNB2CHRNA4CHRNB4 |
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-105849097-A | Substituted pyridine derivatives as GSK-3 inhibitors | 百时美施贵宝公司 | 2016-08-10 | — | — | CN | disclosed |