Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | JAK2 | O60674 | 7/20 | 0.45 |
| ▸ | NTRK1 | P04629 | 7/20 | 0.45 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.43 |
| ▸ | CHRNA1 | P02708 | 3/20 | 0.42 |
| ▸ | CHRNB4 | P30926 | 3/20 | 0.42 |
| ▸ | CHRNA3 | P32297 | 3/20 | 0.42 |
| ▸ | CHRNB2 | P17787 | 2/20 | 0.42 |
| ▸ | CHRNA4 | P43681 | 2/20 | 0.42 |
| ▸ | CHRNG | P07510 | 1/20 | 0.42 |
| ▸ | CHRNB1 | P11230 | 1/20 | 0.42 |
| ▸ | CHRND | Q07001 | 1/20 | 0.42 |
| ▸ | CHRNA2 | Q15822 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL7098412 | 0.96 | RIPK1 (0.43) | JAK2NTRK1RIPK1CHRNA1CHRNB4 | |
| SCHEMBL7097552 | 0.94 | RIPK1 (0.42) | JAK2NTRK1RIPK1CHRNA1CHRNB4 | |
| SCHEMBL7103956 | 0.82 | CHRNB4 (0.39) | CHRNA1CHRNB4CHRNA3CHRNB2CHRNA4 | |
| SCHEMBL1538366 | 0.80 | CHRNB4 (0.62) | CHRNA1CHRNB4CHRNA3CHRNB2CHRNA4 | |
| SCHEMBL1538368 | 0.80 | CHRNB4 (0.62) | CHRNA1CHRNB4CHRNA3CHRNB2CHRNA4 | |
| SCHEMBL29422913 | 0.80 | CHRNB4 (0.62) | CHRNA1CHRNB4CHRNA3CHRNB2CHRNA4 | |
| SCHEMBL7097541 | 0.80 | CHRNB2 (0.43) | CHRNA1CHRNB4CHRNA3CHRNB2CHRNA4 | |
| SCHEMBL7101836 | 0.79 | CHRNA3 (0.51) | CHRNA1CHRNB4CHRNA3CHRNB2CHRNA4 | |
| SCHEMBL7099210 | 0.79 | CHRNA3 (0.69) | CHRNA1CHRNB4CHRNA3CHRNB2CHRNA4 | |
| SCHEMBL18783100 | 0.78 | RIPK1 (0.54) | JAK2NTRK1RIPK1CHRNB4CHRNA3 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| JP-2003500402-A | — | — | 2003-01-07 | — | — | JP | claimed |
| EP-1178982-A1 | HETEROCYCLIC SUBSTITUTED AMINOAZACYCLES USEFUL AS CENTRAL NERVOUS SYSTEM AGENTS | ABBOTT LABORATORIES (US) | 2002-02-13 | — | — | EP | claimed |
| WO-2000071534-A1 | HETEROCYCLIC SUBSTITUTED AMINOAZACYCLES USEFUL AS CENTRAL NERVOUS SYSTEM AGENTS | ABBOTT LABORATORIES (US) | 2000-11-30 | — | — | WO | claimed |