Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.35 |
| ▸ | UGCG | Q16739 | 3/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.34 |
| ▸ | ACACB | O00763 | 1/20 | 0.34 |
| ▸ | CCKBR | P32239 | 3/20 | 0.34 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL4464709 | 0.84 | SMN1; SMN2 (0.39) | ALDH1A1SMN1; SMN2CYP3A4ACACB | |
| SCHEMBL13409008 | 0.82 | CYP1A2 (0.39) | ALDH1A1SMN1; SMN2CYP1A2TDP1CYP3A4 | |
| SCHEMBL13409018 | 0.79 | SMN1; SMN2 (0.52) | ALDH1A1SMN1; SMN2CYP1A2TDP1CYP3A4 | |
| SCHEMBL17378445 | 0.76 | CYP1A2 (0.41) | ALDH1A1SMN1; SMN2CYP1A2TDP1CYP3A4 | |
| SCHEMBL28491402 | 0.75 | PPID (0.46) | ALDH1A1SMN1; SMN2CYP1A2TDP1HSD17B10 | |
| SCHEMBL15870265 | 0.75 | CYP1A2 (0.40) | ALDH1A1SMN1; SMN2CYP1A2TDP1CYP3A4 | |
| SCHEMBL221192 | 0.73 | MAPT (0.52) | ALDH1A1SMN1; SMN2KDM4E | |
| SCHEMBL221191 | 0.73 | MAPT (0.52) | ALDH1A1SMN1; SMN2KDM4E | |
| SCHEMBL4456772 | 0.73 | MAPT (0.52) | ALDH1A1SMN1; SMN2KDM4E | |
| SCHEMBL11124472 | 0.72 | PPID (0.44) | ALDH1A1SMN1; SMN2 |
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-2009151744-A1 | S-NITROSOMERCAPTO COMPOUNDS AND RELATED DERIVATIVES | GALLEON PHARMACEUTICALS, INC. (US) | 2009-12-17 | — | — | WO | claimed |
| WO-2009151744-A1 | S-NITROSOMERCAPTO COMPOUNDS AND RELATED DERIVATIVES | GALLEON PHARMACEUTICALS, INC. (US) | 2009-12-17 | — | — | WO | disclosed |