Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA1 | P30542 | 1/20 | 0.50 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.50 |
| ▸ | NPC1 | O15118 | 8/20 | 0.48 |
| ▸ | RAB9A | P51151 | 8/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 6/20 | 0.48 |
| ▸ | CSNK1D | P48730 | 3/20 | 0.48 |
| ▸ | GAA | P10253 | 3/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.48 |
| ▸ | NCS1 | P62166 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.45 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.45 |
| ▸ | NFKB2 | Q00653 | 2/20 | 0.45 |
| ▸ | RELA | Q04206 | 2/20 | 0.45 |
| ▸ | POLB | P06746 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 3/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.45 |
| ▸ | SCD | O00767 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 2/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL4452888 | 1.00 | ADORA1 (0.50) | ADORA1DYRK1ANPC1RAB9ASMN1; SMN2 | |
| SCHEMBL4455524 | 0.89 | NPC1 (0.48) | ADORA1DYRK1ANPC1RAB9ASMN1; SMN2 | |
| SCHEMBL4455522 | 0.89 | NPC1 (0.48) | ADORA1DYRK1ANPC1RAB9ASMN1; SMN2 | |
| SCHEMBL23273787 | 0.88 | NPC1 (0.50) | ADORA1DYRK1ANPC1RAB9ASMN1; SMN2 | |
| SCHEMBL4459671 | 0.84 | CSNK1D (0.48) | ADORA1DYRK1ANPC1RAB9ASMN1; SMN2 | |
| SCHEMBL4459664 | 0.84 | CSNK1D (0.48) | ADORA1DYRK1ANPC1RAB9ASMN1; SMN2 | |
| SCHEMBL4457418 | 0.83 | CSNK1D (0.54) | ADORA1DYRK1ANPC1RAB9ASMN1; SMN2 | |
| SCHEMBL4457424 | 0.83 | CSNK1D (0.54) | ADORA1DYRK1ANPC1RAB9ASMN1; SMN2 | |
| SCHEMBL4457438 | 0.82 | CSNK1D (0.46) | ADORA1DYRK1ANPC1RAB9ASMN1; SMN2 | |
| SCHEMBL4457435 | 0.82 | CSNK1D (0.46) | ADORA1DYRK1ANPC1RAB9ASMN1; 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 3 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 |
| WO-2009151744-A1 | S-NITROSOMERCAPTO COMPOUNDS AND RELATED DERIVATIVES | GALLEON PHARMACEUTICALS, INC. (US) | 2009-12-17 | — | — | WO | disclosed |