Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC22A6 | Q4U2R8 | 1/20 | 0.58 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.47 |
| ▸ | CLK1 | P49759 | 2/20 | 0.43 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.43 |
| ▸ | CDK5R1 | Q15078 | 1/20 | 0.43 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.39 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.39 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.39 |
| ▸ | PBRM1 | Q86U86 | 1/20 | 0.39 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.39 |
| ▸ | FGFR2 | P21802 | 1/20 | 0.39 |
| ▸ | FGFR3 | P22607 | 1/20 | 0.39 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | ESR1 | P03372 | 1/20 | 0.37 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.37 |
| ▸ | ITGA2B | P08514 | 1/20 | 0.37 |
| ▸ | HMGB1 | P09429 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL28967614 | 0.84 | CYP2A6 (0.47) | SLC22A6CYP2A6CLK1CDK5CDK5R1 | |
| SCHEMBL27708215 | 0.84 | CYP2A6 (0.44) | SLC22A6CYP2A6CLK1CDK5CDK5R1 | |
| SCHEMBL27699966 | 0.84 | CYP2A6 (0.44) | SLC22A6CYP2A6CLK1CDK5CDK5R1 | |
| SCHEMBL27920584 | 0.83 | SLC22A6 (0.59) | SLC22A6MTNR1AMTNR1BNR4A2PBRM1 | |
| SCHEMBL8578221 | 0.81 | SLC22A6 (0.58) | SLC22A6MTNR1AMTNR1BNR4A2PBRM1 | |
| SCHEMBL3362175 | 0.81 | SLC22A6 (0.58) | SLC22A6MTNR1AMTNR1BNR4A2PBRM1 | |
| SCHEMBL154466 | 0.80 | SLC22A6 (0.49) | SLC22A6MTNR1AMTNR1BNR4A2KDM4E | |
| SCHEMBL15348693 | 0.79 | PBRM1 (0.54) | SLC22A6CYP2A6CLK1CDK5CDK5R1 | |
| SCHEMBL25792506 | 0.78 | SLC22A6 (0.58) | SLC22A6MTNR1AMTNR1BNR4A2PBRM1 | |
| SCHEMBL28805815 | 0.78 | SLC22A6 (0.54) | SLC22A6CLK1MTNR1AMTNR1BNR4A2 |
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-101128424-A | Indole compound and use thereof | ONO PHARMACEUTICAL CO (JP) | 2008-02-20 | — | — | CN | disclosed |