Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOA | P21397 | 2/20 | 0.48 |
| ▸ | MAOB | P27338 | 2/20 | 0.48 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.40 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.39 |
| ▸ | TUBB4A | P04350 | 2/20 | 0.39 |
| ▸ | TUBB | P07437 | 2/20 | 0.39 |
| ▸ | TUBA3C | P0DPH7 | 2/20 | 0.39 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.39 |
| ▸ | TUBA1B | P68363 | 2/20 | 0.39 |
| ▸ | TUBA4A | P68366 | 2/20 | 0.39 |
| ▸ | TUBB4B | P68371 | 2/20 | 0.39 |
| ▸ | TUBB3 | Q13509 | 2/20 | 0.39 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.39 |
| ▸ | TUBB2A | Q13885 | 2/20 | 0.39 |
| ▸ | TUBB8 | Q3ZCM7 | 2/20 | 0.39 |
| ▸ | TUBA3E | Q6PEY2 | 2/20 | 0.39 |
| ▸ | TUBA1A | Q71U36 | 2/20 | 0.39 |
| ▸ | HDAC7 | Q8WUI4 | 2/20 | 0.39 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.39 |
| ▸ | HDAC10 | Q969S8 | 2/20 | 0.39 |
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 SCHEMBL9853219 | 0.99 | MAOA (0.47) | MAOAMAOBTRPA1HDAC3TUBB4A | |
| SCHEMBL1369317 | 0.85 | MAOA (0.60) | MAOAMAOBTRPA1HDAC3TUBB4A | |
| Hydrochloric Acid SCHEMBL9853244 | 0.81 | ALDH1A1 (0.46) | HDAC3TUBB4ATUBBTUBA3CHDAC4 | |
| SCHEMBL9853302 | 0.78 | SLC6A4 (0.51) | MAOBHDAC3TUBB4ATUBBTUBA3C | |
| SCHEMBL10475573 | 0.76 | SLC6A4 (0.56) | HDAC3TUBB4ATUBBTUBA3CHDAC4 | |
| SCHEMBL9853218 | 0.76 | NR1H2 (0.50) | MAOAMAOBHDAC3TUBB4ATUBB | |
| Hydrochloric Acid SCHEMBL10475278 | 0.75 | SLC6A4 (0.55) | HDAC3TUBB4ATUBBTUBA3CHDAC4 | |
| Hydrochloric Acid SCHEMBL9853274 | 0.75 | NR1H2 (0.49) | MAOAMAOBHDAC3TUBB4ATUBB | |
| SCHEMBL24039969 | 0.70 | MAOA (0.47) | MAOAMAOBTRPA1HDAC3HDAC6 | |
| SCHEMBL30896650 | 0.69 | MAOB (0.65) | MAOAMAOBTRPA1CA12CA2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4940704-A | Pyrido[3,4-b][1,4]benzoxazepines | HOECHST-ROUSSEL PHARMACEUTICAL INC. (US) | 1990-07-10 | — | — | US | claimed |
| 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 |