Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | HTT | P42858 | 2/20 | 0.41 |
| ▸ | APLNR | P35414 | 1/20 | 0.41 |
| ▸ | BCL2A1 | Q16548 | 4/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.39 |
| ▸ | PSEN1 | P49768 | 1/20 | 0.39 |
| ▸ | PSEN2 | P49810 | 1/20 | 0.39 |
| ▸ | APH1B | Q8WW43 | 1/20 | 0.39 |
| ▸ | NCSTN | Q92542 | 1/20 | 0.39 |
| ▸ | APH1A | Q96BI3 | 1/20 | 0.39 |
| ▸ | PSENEN | Q9NZ42 | 1/20 | 0.39 |
| ▸ | BCHE | P06276 | 1/20 | 0.39 |
| ▸ | ACHE | P22303 | 1/20 | 0.39 |
| ▸ | YAP1 | P46937 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL4573275 | 1.00 | ALDH1A1 (0.41) | ALDH1A1SMN1; SMN2HTTAPLNRBCL2A1 | |
| SCHEMBL25252107 | 0.74 | SMN1; SMN2 (0.57) | ALDH1A1SMN1; SMN2HTTBCL2A1TDP1 | |
| SCHEMBL13396259 | 0.74 | SMN1; SMN2 (0.57) | ALDH1A1SMN1; SMN2HTTBCL2A1TDP1 | |
| SCHEMBL19284750 | 0.72 | APLNR (0.54) | APLNR | |
| SCHEMBL19284814 | 0.72 | APLNR (0.54) | APLNR | |
| SCHEMBL19284751 | 0.72 | APLNR (0.54) | APLNR | |
| SCHEMBL20447205 | 0.72 | ALDH1A1 (0.54) | ALDH1A1SMN1; SMN2HTTBCL2A1TDP1 | |
| SCHEMBL15209869 | 0.72 | APLNR (0.44) | ALDH1A1SMN1; SMN2HTTAPLNRBCL2A1 | |
| SCHEMBL15209867 | 0.72 | APLNR (0.44) | ALDH1A1SMN1; SMN2HTTAPLNRBCL2A1 | |
| SCHEMBL8922383 | 0.71 | ATM (0.43) | ALDH1A1SMN1; SMN2HTTTDP1TSHR |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2008031788-A1 | AMINOAZEPINE DERIVATIVES AS HIGHLY EFFICIENT INHIBITORS OF THE INDUCIBLE NITRIC OXIDE SYNTHASE | NYCOMED GMBH (DE) | 2008-03-20 | — | — | WO | disclosed |
| WO-2008031788-A1 | AMINOAZEPINE DERIVATIVES AS HIGHLY EFFICIENT INHIBITORS OF THE INDUCIBLE NITRIC OXIDE SYNTHASE | NYCOMED GMBH (DE) | 2008-03-20 | — | — | WO | disclosed |