Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX1 | P07099 | 7/20 | 0.39 |
| ▸ | ACHE | P22303 | 7/20 | 0.36 |
| ▸ | MMP2 | P08253 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.35 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.35 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.35 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.35 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.35 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.35 |
| ▸ | GRIN3A | Q8TCU5 | 1/20 | 0.35 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.35 |
| ▸ | ZDHHC20 | Q5W0Z9 | 1/20 | 0.34 |
| ▸ | ZDHHC2 | Q9UIJ5 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL27253956 | 0.94 | EPHX1 (0.43) | EPHX1ZDHHC20ZDHHC2TSHR | |
| SCHEMBL20123226 | 0.92 | EPHX1 (0.47) | EPHX1ZDHHC20ZDHHC2 | |
| SCHEMBL21393320 | 0.92 | EPHX1 (0.47) | EPHX1ZDHHC20ZDHHC2 | |
| SCHEMBL19176980 | 0.86 | KDM4C (0.36) | EPHX1MMP2 | |
| SCHEMBL21236727 | 0.83 | — | — | |
| SCHEMBL24950632 | 0.81 | FFAR1 (0.30) | — | |
| SCHEMBL24488462 | 0.79 | TDP1 (0.33) | EPHX1 | |
| SCHEMBL25720915 | 0.79 | EPHX1 (0.38) | EPHX1SIGMAR1 | |
| SCHEMBL24760330 | 0.79 | MMP9 (0.33) | MEN1KMT2ATSHR | |
| SCHEMBL20005315 | 0.79 | EPHX1 (0.34) | EPHX1ACHEMMP2HTTMEN1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3641756-B1 | TRICYCLIC COMPOUNDS AS CYP1 INHIBITORS | MASSACHUSETTS GEN HOSPITAL (US) | 2023-08-09 | — | — | EP | disclosed |
| EP-3178818-A1 | PYRAZOLYL QUINOXALINE KINASE INHIBITORS | Astex Therapeutics Limited (GB) | 2017-06-14 | — | — | EP | disclosed |