Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A1 | P04798 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.36 |
| ▸ | MAP3K7 | O43318 | 1/20 | 0.33 |
| ▸ | TAB1 | Q15750 | 1/20 | 0.33 |
| ▸ | ENPP2 | Q13822 | 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 | |
|---|---|---|---|---|
| SCHEMBL10508816 | 1.00 | CYP1A1 (0.36) | CYP1A1CYP1A2CYP1B1MAP3K7TAB1 | |
| SCHEMBL22029594 | 0.81 | APOBEC3G (0.36) | CYP1A1CYP1A2CYP1B1MAP3K7TAB1 | |
| SCHEMBL21457115 | 0.81 | MGLL (0.36) | CYP1A1CYP1A2CYP1B1MAP3K7TAB1 | |
| SCHEMBL21457114 | 0.81 | MGLL (0.36) | CYP1A1CYP1A2CYP1B1MAP3K7TAB1 | |
| SCHEMBL10383610 | 0.79 | KDM4E (0.40) | MAP3K7TAB1ENPP2KDM4E | |
| SCHEMBL11076690 | 0.78 | TAAR1 (0.42) | CYP1A2MAP3K7TAB1 | |
| SCHEMBL21457575 | 0.74 | HSD11B1 (0.48) | ENPP2KDM4E | |
| SCHEMBL11047196 | 0.74 | TSHR (0.32) | CYP1A2 | |
| SCHEMBL2000509 | 0.74 | HSD11B1 (0.48) | ENPP2KDM4E | |
| SCHEMBL10694546 | 0.73 | — | — |
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-5508417-A | FUNGICIDES, BACTERICIDES, ALGICIDE | ROHM AND HAAS COMPANY (US) | 1996-04-16 | — | — | US | disclosed |