Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 2/20 | 0.60 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.54 |
| ▸ | PPID | Q08752 | 1/20 | 0.53 |
| ▸ | MAPT | P10636 | 4/20 | 0.52 |
| ▸ | LMNA | P02545 | 3/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.52 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.52 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.52 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.52 |
| ▸ | APEX1 | P27695 | 1/20 | 0.52 |
| ▸ | RECQL | P46063 | 1/20 | 0.52 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.52 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.51 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.51 |
| ▸ | TSHR | P16473 | 1/20 | 0.51 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.51 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.49 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.49 |
| ▸ | NAMPT | P43490 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL8631712 | 0.88 | GAA (0.50) | GAASMN1; SMN2PPIDMAPTLMNA | |
| SCHEMBL7396978 | 0.86 | CA12 (0.57) | SMN1; SMN2LMNAALDH1A1TDP1NPC1 | |
| SCHEMBL473103 | 0.84 | TDP1 (0.55) | GAASMN1; SMN2LMNAALDH1A1RECQL | |
| SCHEMBL9212256 | 0.83 | HDAC3 (0.58) | GAASMN1; SMN2MAPTLMNAALDH1A1 | |
| SCHEMBL7434290 | 0.83 | KCNQ3 (0.53) | GAASMN1; SMN2MAPTLMNAALDH1A1 | |
| Benzene SCHEMBL8878788 | 0.82 | PPID (0.64) | GAASMN1; SMN2PPIDMAPTLMNA | |
| SCHEMBL423344 | 0.82 | PPID (0.64) | GAASMN1; SMN2PPIDMAPTLMNA | |
| SCHEMBL2918702 | 0.82 | GAA (0.64) | GAASMN1; SMN2MAPTLMNAALDH1A1 | |
| SCHEMBL28453979 | 0.82 | SLC26A6 (0.46) | GAASMN1; SMN2LMNAKDM4ETDP1 | |
| SCHEMBL474570 | 0.82 | SMN1; SMN2 (0.53) | SMN1; SMN2LMNAALDH1A1TDP1TSHR |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-102695545-B | Compositions comprising enzymatically cleavable ketone-modified opioid prodrugs and optional inhibitors thereof | 特色疗法股份有限公司 | 2016-08-17 | — | — | CN | disclosed |
| CN-102917589-A | Compositions comprising enzyme-cleavable opioid prodrugs and inhibitors thereof | SIGNATURE THERAPEUTICS INC | 2013-02-06 | — | — | CN | disclosed |
| CN-102695545-A | Compositions comprising enzymatically cleavable ketone-modified opioid prodrugs and optional inhibitors thereof | SIGNATURE THERAPEUTICS INC | 2012-09-26 | — | — | CN | disclosed |
| EP-0640594-A1 | Hydantoin derivative as metalloprotease inhibitor | FUJIREBIO INC. (JP) | 1995-03-01 | — | — | EP | disclosed |