Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IP6K1 | Q92551 | 7/20 | 0.38 |
| ▸ | IP6K3 | Q96PC2 | 3/20 | 0.38 |
| ▸ | IP6K2 | Q9UHH9 | 3/20 | 0.38 |
| ▸ | EDNRA | P25101 | 1/20 | 0.34 |
| ▸ | PARP1 | P09874 | 6/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.34 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.34 |
| ▸ | CA12 | O43570 | 1/20 | 0.34 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.34 |
| ▸ | CA9 | Q16790 | 1/20 | 0.34 |
| ▸ | TNKS2 | Q9H2K2 | 1/20 | 0.34 |
| ▸ | GABRA1 | P14867 | 2/20 | 0.33 |
| ▸ | GABRG2 | P18507 | 2/20 | 0.33 |
| ▸ | GABRB3 | P28472 | 2/20 | 0.33 |
| ▸ | GABRA5 | P31644 | 2/20 | 0.33 |
| ▸ | GABRA3 | P34903 | 2/20 | 0.33 |
| ▸ | GABRA2 | P47869 | 2/20 | 0.33 |
| ▸ | GABRA6 | Q16445 | 2/20 | 0.33 |
| ▸ | ATM | Q13315 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL15558785 | 0.79 | KDM4E (0.48) | SMN1; SMN2KDM4EALDH1A1HPGDHTT | |
| SCHEMBL5505380 | 0.73 | IP6K1 (0.44) | IP6K1IP6K3IP6K2PARP1SMN1; SMN2 | |
| Formic Acid SCHEMBL10727380 | 0.71 | PDPK1 (0.50) | IP6K1IP6K3IP6K2PARP1SMN1; SMN2 | |
| Acetic Acid SCHEMBL10727228 | 0.70 | SMN1; SMN2 (0.49) | PARP1SMN1; SMN2PDPK1CA12ALOX15 | |
| Formic Acid SCHEMBL10738924 | 0.70 | PDPK1 (0.49) | IP6K1IP6K3IP6K2PARP1SMN1; SMN2 | |
| SCHEMBL202156 | 0.70 | PDPK1 (0.55) | PARP1SMN1; SMN2PDPK1CA12ALOX15 | |
| SCHEMBL29508386 | 0.70 | PDPK1 (0.55) | PARP1SMN1; SMN2PDPK1CA12ALOX15 | |
| Acetic Acid SCHEMBL10742452 | 0.69 | SMN1; SMN2 (0.47) | PARP1SMN1; SMN2PDPK1CA12ALOX15 | |
| SCHEMBL16618906 | 0.69 | SLC2A1 (0.49) | IP6K1IP6K3IP6K2PARP1SMN1; SMN2 | |
| Hydrochloric Acid SCHEMBL4766699 | 0.68 | PDPK1 (0.53) | PARP1SMN1; SMN2PDPK1CA12ALOX15 |
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 |