Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM2 | P08172 | 2/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 2/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | ELANE | P08246 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 3/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL14392995 | 0.86 | CHRM2 (0.40) | CHRM2L3MBTL1HPGDNPSR1ELANE | |
| SCHEMBL3175482 | 0.76 | CHRM2 (0.49) | CHRM2HPGDMAPTRAB9AALDH1A1 | |
| SCHEMBL18355157 | 0.74 | HPGD (0.53) | L3MBTL1HPGDNPSR1MAPTSMN1; SMN2 | |
| SCHEMBL7524646 | 0.72 | KEAP1 (0.60) | HPGDNPSR1MAPTSMN1; SMN2ALDH1A1 | |
| SCHEMBL29596524 | 0.72 | KEAP1 (0.60) | HPGDNPSR1MAPTSMN1; SMN2ALDH1A1 | |
| SCHEMBL16761225 | 0.72 | CHRM2 (0.46) | CHRM2ALDH1A1 | |
| SCHEMBL9625482 | 0.71 | CHRM2 (0.63) | CHRM2ALDH1A1 | |
| SCHEMBL5962347 | 0.71 | CHRM2 (0.54) | CHRM2ALDH1A1 | |
| SCHEMBL17395714 | 0.71 | GAA (0.62) | MAPTSMN1; SMN2TP53ALDH1A1 | |
| SCHEMBL15216192 | 0.70 | CHRM2 (0.47) | CHRM2ALDH1A1 |
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-2011112969-A1 | POLY(ETHYLENE GLYCOL) DERIVATIVES FOR METAL-FREE CLICK CHEMISTRY | INTEZYNE TECHNOLOGIES, INC. (US) | 2011-09-15 | — | — | WO | disclosed |