Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOS3 | P29474 | 1/20 | 0.49 |
| ▸ | NOS1 | P29475 | 1/20 | 0.49 |
| ▸ | NOS2 | P35228 | 1/20 | 0.49 |
| ▸ | NPC1 | O15118 | 5/20 | 0.39 |
| ▸ | RAB9A | P51151 | 4/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.36 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 2/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.36 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.36 |
| ▸ | MAPK13 | O15264 | 1/20 | 0.33 |
| ▸ | MAPK12 | P53778 | 1/20 | 0.33 |
| ▸ | MAPK11 | Q15759 | 1/20 | 0.33 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.33 |
| ▸ | CES1 | P23141 | 1/20 | 0.33 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.32 |
| ▸ | ACHE | P22303 | 5/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL7873710 | 0.85 | NOS3 (0.38) | NOS3NOS1NOS2NPC1RAB9A | |
| SCHEMBL8994244 | 0.78 | PDE3B (0.42) | ALDH1A1PDE3BPDE3ALMNACYP3A4 | |
| SCHEMBL14730907 | 0.78 | ACHE (0.36) | PDE3BPDE3AACHESRD5A1 | |
| SCHEMBL9279571 | 0.74 | KDM4E (0.45) | NOS3NOS1NOS2NPC1RAB9A | |
| SCHEMBL14141233 | 0.69 | NOS3 (0.54) | NOS3NOS1NOS2RAB9AOPRM1 | |
| SCHEMBL2075410 | 0.66 | NOS3 (1.00) | NOS3NOS1NOS2NPC1RAB9A | |
| Hydrochloric Acid SCHEMBL8324907 | 0.65 | NOS3 (0.96) | NOS3NOS1NOS2NPC1RAB9A | |
| SCHEMBL30804593 | 0.65 | MAOA (0.38) | NPC1RAB9AALDH1A1MAPTHPGD | |
| SCHEMBL3348606 | 0.65 | MAOA (0.38) | NPC1RAB9AALDH1A1MAPTHPGD | |
| SCHEMBL19968930 | 0.64 | NPSR1 (0.35) | HPGD |
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 |
|---|---|---|---|---|---|---|---|
| EP-0542019-B1 | 8-Hydroxy-2H-dibenz(b,f) azepin-2 one dyes | BAYER AG (US) | 1996-08-14 | — | — | EP | disclosed |
| EP-0542019-A1 | 8-Hydroxy-2H-dibenz(b,f) azepin-2 one dyes | Bayer Corporation (US) | 1993-05-19 | — | — | EP | disclosed |
| US-5208326-A | 8-HYDROXY-2H-DIBENZ(B,F)AZEPIN-2-ONE DYES | MILES INC. (US) | 1993-05-04 | — | — | US | disclosed |