Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 2/20 | 0.47 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.47 |
| ▸ | MGAM | O43451 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | SI | P14410 | 1/20 | 0.46 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 2/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | GSTP1 | P09211 | 1/20 | 0.42 |
| ▸ | CA12 | O43570 | 1/20 | 0.42 |
| ▸ | CA1 | P00915 | 1/20 | 0.42 |
| ▸ | CA2 | P00918 | 1/20 | 0.42 |
| ▸ | CA4 | P22748 | 1/20 | 0.42 |
| ▸ | CA7 | P43166 | 1/20 | 0.42 |
| ▸ | CA9 | Q16790 | 1/20 | 0.42 |
| ▸ | MAOA | P21397 | 3/20 | 0.42 |
| ▸ | MAOB | P27338 | 3/20 | 0.42 |
| ▸ | LTA4H | P09960 | 3/20 | 0.41 |
| ▸ | ACHE | P22303 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 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 | |
|---|---|---|---|---|
| SCHEMBL4278557 | 0.91 | CA12 (0.49) | GAAGSTP1CA12CA1CA2 | |
| SCHEMBL12516724 | 0.90 | ESR1 (0.53) | ESR1ESR2MGAMGAASI | |
| SCHEMBL15803992 | 0.86 | CA12 (0.45) | MEN1KMT2AGSTP1CA12CA1 | |
| SCHEMBL975819 | 0.86 | CA12 (0.53) | ESR1ESR2MGAMGAASI | |
| SCHEMBL23813386 | 0.85 | MAOB (0.48) | ESR1ESR2MEN1KMT2AGSTP1 | |
| SCHEMBL13592454 | 0.83 | GSTP1 (0.38) | MGAMGAASIMGAM2GSTP1 | |
| SCHEMBL13592453 | 0.81 | GSTP1 (0.42) | MGAMGAASIMGAM2GSTP1 | |
| SCHEMBL14901605 | 0.80 | GSTP1 (0.58) | ESR1ESR2MGAMGAASI | |
| SCHEMBL14901603 | 0.80 | LTA4H (0.57) | ESR1ESR2MGAMGAASI | |
| SCHEMBL8161375 | 0.80 | CA12 (0.49) | MEN1KMT2AGSTP1CA12CA1 |
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-2008048733-A1 | 1,3-DIPOLAR CYCLOADDITION OF AZIDES TO ALKYNES | HENKEL AG & CO. KGAA (DE) | 2008-04-24 | — | — | WO | disclosed |