Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTNNB1 | P35222 | 2/20 | 0.47 |
| ▸ | WNT3A | P56704 | 2/20 | 0.47 |
| ▸ | IP6K1 | Q92551 | 4/20 | 0.45 |
| ▸ | IP6K3 | Q96PC2 | 1/20 | 0.45 |
| ▸ | IP6K2 | Q9UHH9 | 1/20 | 0.45 |
| ▸ | RAB9A | P51151 | 3/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | HPGD | P15428 | 2/20 | 0.41 |
| ▸ | HTT | P42858 | 2/20 | 0.41 |
| ▸ | GLA | P06280 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.39 |
| ▸ | NAMPT | P43490 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL4365069 | 0.88 | CTNNB1 (0.47) | CTNNB1WNT3AIP6K1IP6K3IP6K2 | |
| SCHEMBL15558786 | 0.79 | CTNNB1 (0.68) | CTNNB1WNT3ARAB9AALDH1A1SMN1; SMN2 | |
| SCHEMBL16618906 | 0.76 | SLC2A1 (0.49) | CTNNB1WNT3AIP6K1IP6K3IP6K2 | |
| Acetic Acid SCHEMBL10727228 | 0.72 | SMN1; SMN2 (0.49) | RAB9AALDH1A1SMN1; SMN2KDM4EHPGD | |
| Acetic Acid SCHEMBL10742452 | 0.71 | SMN1; SMN2 (0.47) | RAB9AALDH1A1SMN1; SMN2KDM4EHPGD | |
| SCHEMBL26003352 | 0.69 | KDM4E (0.42) | RAB9AALDH1A1SMN1; SMN2KDM4EHTT | |
| SCHEMBL29508386 | 0.69 | PDPK1 (0.55) | ALDH1A1SMN1; SMN2KDM4EHPGDGLA | |
| SCHEMBL202156 | 0.69 | PDPK1 (0.55) | ALDH1A1SMN1; SMN2KDM4EHPGDGLA | |
| Trifluoroacetic Acid SCHEMBL29627985 | 0.69 | PARP1 (0.45) | RAB9AALDH1A1SMN1; SMN2KDM4EHPGD | |
| SCHEMBL15558784 | 0.69 | CTNNB1 (0.72) | CTNNB1WNT3ARAB9AALDH1A1SMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| US-7485432-B2 | Selective modulation of TLR-mediated biological activity | 3M INNOVATIVE PROPERTIES COMPANY (US) | 2009-02-03 | — | — | US | disclosed |