Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPR3 | P46089 | 1/20 | 0.43 |
| ▸ | SOS2 | Q07890 | 1/20 | 0.41 |
| ▸ | PSMB8 | P28062 | 1/20 | 0.39 |
| ▸ | MET | P08581 | 1/20 | 0.37 |
| ▸ | LIMK1 | P53667 | 1/20 | 0.36 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.36 |
| ▸ | CDK5R1 | Q15078 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.35 |
| ▸ | GABRP | O00591 | 1/20 | 0.35 |
| ▸ | GABRD | O14764 | 1/20 | 0.35 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.35 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.35 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.35 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.35 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.35 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.35 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.35 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.35 |
| ▸ | GABRA4 | P48169 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL14629295 | 0.73 | GPR3 (0.41) | GPR3PSMB8LIMK1CDK5CDK5R1 | |
| SCHEMBL24056925 | 0.73 | GPR3 (0.48) | GPR3PSMB8LIMK1CDK5CDK5R1 | |
| SCHEMBL15747056 | 0.73 | GPR3 (0.48) | GPR3LIMK1CDK5CDK5R1KDM4E | |
| SCHEMBL16693485 | 0.73 | GPR3 (0.48) | GPR3LIMK1CDK5CDK5R1KDM4E | |
| SCHEMBL3341584 | 0.71 | SOS2 (0.59) | SOS2METKDM4EALDH1A1MAPT | |
| SCHEMBL1512630 | 0.70 | GPR3 (0.40) | GPR3PSMB8LIMK1CDK5CDK5R1 | |
| SCHEMBL4828993 | 0.70 | GPR3 (0.45) | GPR3LIMK1CDK5CDK5R1ALDH1A1 | |
| SCHEMBL15746023 | 0.69 | GPR3 (0.43) | GPR3LIMK1CDK5CDK5R1KDM4E | |
| SCHEMBL16982165 | 0.68 | GPR3 (0.42) | GPR3LIMK1CDK5CDK5R1KDM4E | |
| Dibenzothiophene SCHEMBL28138470 | 0.67 | GPR3 (0.93) | GPR3LIMK1KDM4EALDH1A1MAPT |
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 |
|---|---|---|---|---|---|---|---|
| EP-1739081-A1 | HYDRAZINO-SUBSTITUTED HETEROCYCLIC NITRILE COMPOUNDS AND USE THEREOF | ONO PHARMACEUTICAL CO., LTD. (JP) | 2007-01-03 | — | — | EP | disclosed |