Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALOX15B | O15296 | 1/20 | 0.38 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.35 |
| ▸ | LTA4H | P09960 | 1/20 | 0.34 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.34 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.34 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.34 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.34 |
| ▸ | ADK | P55263 | 1/20 | 0.33 |
| ▸ | EIF4A1 | P60842 | 1/20 | 0.33 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.32 |
| ▸ | DHFR | P00374 | 1/20 | 0.32 |
| ▸ | KCNH2 | Q12809 | 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 | |
|---|---|---|---|---|
| SCHEMBL18217198 | 0.88 | ALOX15B (0.32) | ALOX15BALOX12PTPN1LTA4HCYP17A1 | |
| SCHEMBL20176731 | 0.86 | GLA (0.31) | ALOX15BALOX12LTA4HCYP17A1CYP11B1 | |
| SCHEMBL20176737 | 0.84 | CASP3 (0.33) | ALOX15BALOX12ADKNR1H4 | |
| SCHEMBL20176717 | 0.83 | KDM4E (0.41) | KDM4ERAB9APTPN1HSD11B1EIF4A1 | |
| SCHEMBL20176724 | 0.82 | KDM4E (0.40) | KDM4ERAB9APTPN1HSD11B1EIF4A1 | |
| SCHEMBL23723956 | 0.81 | ADK (0.36) | ALOX15BALOX12KDM4EADKNR1H4 | |
| SCHEMBL20176733 | 0.81 | KDM4E (0.39) | KDM4ERAB9APTPN1HSD11B1EIF4A1 | |
| SCHEMBL25451093 | 0.80 | KDM4E (0.40) | KDM4ERAB9AHSD11B1 | |
| SCHEMBL20176727 | 0.80 | RAB9A (0.42) | KDM4ERAB9APTPN1HSD11B1EIF4A1 | |
| SCHEMBL24641094 | 0.80 | FFAR1 (0.40) | KDM4ERAB9A |
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-20180142153-A1 | THIADIAZOLOQUINOXALINE DERIVATIVES | MERCK PATENT GMBH (DE) | 2018-05-24 | — | — | US | disclosed |