Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GSR | P00390 | 1/20 | 0.37 |
| ▸ | TXNRD1 | Q16881 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | PIK3C3 | Q8NEB9 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | NAMPT | P43490 | 4/20 | 0.32 |
| ▸ | CNR1 | P21554 | 1/20 | 0.31 |
| ▸ | GCK | P35557 | 1/20 | 0.30 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL2178179 | 0.77 | ALDH1A1 (0.34) | MEN1KMT2APIK3C3ALDH1A1NAMPT | |
| SCHEMBL2179060 | 0.76 | GCK (0.40) | NAMPTGCKCYP2C9 | |
| SCHEMBL2179861 | 0.76 | GSR (0.37) | GSRTXNRD1MEN1KMT2AGCK | |
| SCHEMBL2178449 | 0.71 | PIK3C3 (0.37) | PIK3C3NAMPTGCKCYP2C9 | |
| SCHEMBL2178622 | 0.69 | NAMPT (0.34) | PIK3C3NAMPTGCKCYP2C9 | |
| SCHEMBL2179066 | 0.65 | EGLN2 (0.39) | PIK3C3NAMPTGCKCYP2C9 | |
| SCHEMBL2178177 | 0.64 | GCK (0.47) | GCK | |
| SCHEMBL13450386 | 0.63 | MCOLN3 (0.49) | PIK3C3ALDH1A1CNR1 | |
| Hydrochloric Acid SCHEMBL4766194 | 0.61 | SIRT2 (0.39) | MEN1KMT2AALDH1A1CYP2C9 | |
| SCHEMBL217625 | 0.61 | ALDH1A1 (0.48) | GSRTXNRD1MEN1KMT2APIK3C3 |
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-2011080755-A1 | FUSED NITROGEN HETEROCYCLIC COMPOUNDS, PROCESS OF PREPARATION AND USES THEREOF | ADVINUS THERAPEUTICS PRIVATE LIMITED (IN) | 2011-07-07 | — | — | WO | claimed |
| WO-2011080755-A1 | FUSED NITROGEN HETEROCYCLIC COMPOUNDS, PROCESS OF PREPARATION AND USES THEREOF | ADVINUS THERAPEUTICS PRIVATE LIMITED (IN) | 2011-07-07 | — | — | WO | disclosed |