Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | NR3C1 | P04150 | 4/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 3/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | TSHR | P16473 | 2/20 | 0.41 |
| ▸ | AURKA | O14965 | 1/20 | 0.40 |
| ▸ | PIM1 | P11309 | 1/20 | 0.40 |
| ▸ | CDK2 | P24941 | 1/20 | 0.40 |
| ▸ | GSK3B | P49841 | 1/20 | 0.40 |
| ▸ | USP2 | O75604 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL4456592 | 1.00 | MEN1 (0.43) | MEN1KMT2ANR3C1ALDH1A1RAB9A | |
| SCHEMBL4456265 | 0.82 | FDPS (0.46) | NR3C1ALDH1A1RAB9APOLBCYP1A2 | |
| SCHEMBL4460006 | 0.82 | KIF11 (0.44) | KDM4EKIF11 | |
| SCHEMBL4460000 | 0.82 | KIF11 (0.44) | KDM4EKIF11 | |
| SCHEMBL4458423 | 0.80 | ELOVL1 (0.46) | MEN1KMT2AALDH1A1LMNAUSP2 | |
| SCHEMBL4458415 | 0.80 | ELOVL1 (0.46) | MEN1KMT2AALDH1A1LMNAUSP2 | |
| SCHEMBL4457438 | 0.77 | CSNK1D (0.46) | MEN1KMT2AALDH1A1RAB9APOLB | |
| SCHEMBL4457435 | 0.77 | CSNK1D (0.46) | MEN1KMT2AALDH1A1RAB9APOLB | |
| SCHEMBL4457430 | 0.77 | FDPS (0.41) | NR3C1ALDH1A1RAB9APOLBCYP1A2 | |
| SCHEMBL4457429 | 0.77 | FDPS (0.41) | NR3C1ALDH1A1RAB9APOLBCYP1A2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2009151744-A1 | S-NITROSOMERCAPTO COMPOUNDS AND RELATED DERIVATIVES | GALLEON PHARMACEUTICALS, INC. (US) | 2009-12-17 | — | — | WO | disclosed |