Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1H2 | P55055 | 1/20 | 0.50 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.50 |
| ▸ | BRD4 | O60885 | 2/20 | 0.46 |
| ▸ | MAPK7 | Q13164 | 1/20 | 0.46 |
| ▸ | STK17B | O94768 | 1/20 | 0.42 |
| ▸ | CASP3 | P42574 | 1/20 | 0.41 |
| ▸ | TTR | P02766 | 1/20 | 0.40 |
| ▸ | CES1 | P23141 | 1/20 | 0.40 |
| ▸ | CDK8 | P49336 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | MAOA | P21397 | 1/20 | 0.38 |
| ▸ | MAOB | P27338 | 1/20 | 0.38 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.37 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.36 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.36 |
| ▸ | TUBB | P07437 | 1/20 | 0.36 |
| ▸ | TUBA3C | P0DPH7 | 1/20 | 0.36 |
| ▸ | HDAC4 | P56524 | 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL9853274 | 0.99 | NR1H2 (0.49) | NR1H2NR1H3BRD4MAPK7STK17B | |
| SCHEMBL14288741 | 0.82 | NR1H2 (0.58) | NR1H2NR1H3BRD4MAPK7CASP3 | |
| SCHEMBL9853302 | 0.79 | SLC6A4 (0.51) | MAOBHDAC3TUBB4ATUBBTUBA3C | |
| SCHEMBL10475573 | 0.78 | SLC6A4 (0.56) | KDM4EHDAC3TUBB4ATUBBTUBA3C | |
| Hydrochloric Acid SCHEMBL10475278 | 0.77 | SLC6A4 (0.55) | KDM4EHDAC3TUBB4ATUBBTUBA3C | |
| SCHEMBL9853284 | 0.76 | MAOA (0.48) | STK17BCDK8MAOAMAOBHTT | |
| Hydrochloric Acid SCHEMBL9853219 | 0.75 | MAOA (0.47) | STK17BCDK8MAOAMAOBHTT | |
| SCHEMBL17059742 | 0.74 | MAPK7 (0.57) | NR1H2NR1H3BRD4MAPK7CASP3 | |
| SCHEMBL9853429 | 0.73 | NR1H2 (0.47) | NR1H2NR1H3BRD4MAPK7CASP3 | |
| SCHEMBL17975306 | 0.72 | NR1H2 (0.51) | NR1H2NR1H3BRD4MAPK7CASP3 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0413300-A1 | Pyrido [3,4-b][1,4] benzoxazepines, a process for their preparation and their use as medicaments | HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) | 1991-02-20 | — | — | EP | claimed |
| JP-3086886-A | — | — | None | — | — | JP | disclosed |
| JP-H0386886-A | PYRIDO(3,4-B)(1,4)BENZOXAZEPIN | HOECHST ROUSSEL PHARMACEUT INC | 1991-04-11 | — | — | JP | disclosed |
| EP-0413300-A1 | Pyrido [3,4-b][1,4] benzoxazepines, a process for their preparation and their use as medicaments | HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) | 1991-02-20 | — | — | EP | disclosed |
| US-4940704-A | Pyrido[3,4-b][1,4]benzoxazepines | HOECHST-ROUSSEL PHARMACEUTICAL INC. (US) | 1990-07-10 | — | — | US | disclosed |