Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 1/20 | 0.46 |
| ▸ | F11 | P03951 | 1/20 | 0.37 |
| ▸ | AHR | P35869 | 2/20 | 0.36 |
| ▸ | F7 | P08709 | 2/20 | 0.36 |
| ▸ | F3 | P13726 | 2/20 | 0.36 |
| ▸ | CMA1 | P23946 | 1/20 | 0.36 |
| ▸ | LTA4H | P09960 | 1/20 | 0.36 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.36 |
| ▸ | PPOX | P50336 | 1/20 | 0.36 |
| ▸ | NOS1 | P29475 | 2/20 | 0.34 |
| ▸ | DYRK1A | Q13627 | 2/20 | 0.34 |
| ▸ | CES1 | P23141 | 2/20 | 0.33 |
| ▸ | TGM2 | P21980 | 1/20 | 0.33 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.32 |
| ▸ | DAPK3 | O43293 | 1/20 | 0.32 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.32 |
| ▸ | RET | P07949 | 1/20 | 0.32 |
| ▸ | PIM1 | P11309 | 1/20 | 0.32 |
| ▸ | LTK | P29376 | 1/20 | 0.32 |
| ▸ | GRK5 | P34947 | 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 | |
|---|---|---|---|---|
| SCHEMBL5439659 | 0.80 | PPOX (0.50) | AHRF7F3PPOXDYRK1A | |
| SCHEMBL3229744 | 0.76 | ALDH1A1 (0.41) | CYP2A6ACHENOX1TP53KDM4E | |
| SCHEMBL7583854 | 0.75 | CYP2A6 (0.46) | CYP2A6AHRNR4A2NOS1DYRK1A | |
| SCHEMBL3218707 | 0.75 | ALDH1A1 (0.43) | CYP2A6NOX1TP53KDM4EKMT2A | |
| SCHEMBL4288341 | 0.74 | CYP2A6 (0.68) | CYP2A6F11AHRF7F3 | |
| SCHEMBL11626337 | 0.74 | CYP2A6 (0.68) | CYP2A6F11AHRF7F3 | |
| SCHEMBL27765004 | 0.74 | CYP2A6 (0.68) | CYP2A6F11AHRF7F3 | |
| SCHEMBL11302716 | 0.74 | CYP2A6 (0.68) | CYP2A6F11AHRF7F3 | |
| SCHEMBL31665941 | 0.74 | CYP2A6 (0.68) | CYP2A6F11AHRF7F3 | |
| SCHEMBL865990 | 0.74 | CYP2A6 (0.77) | CYP2A6F11AHRF7F3 |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| JP-3182563-A | — | — | None | — | — | JP | disclosed |
| EP-0191215-B1 | MEDIA FOR OPTICAL INFORMATION STORAGE COMPRISING AN ORGANIC MACROCYCLIC CHROMOPHORE SUBSTITUTED WITH A FILM CONFERRING ORGANIC SUBSTITUENT | CELANESE CORPORATION (US) | 1992-05-27 | — | — | EP | disclosed |
| US-5059510-A | Media for optical information storage comprising an organic macrocyclic chromophore substituted with a film conferring organic substituent | HOECHST CELANESE CORP. (US) | 1991-10-22 | — | — | US | disclosed |
| JP-H03182563-A | AZAANNULENE COMPOUND | RICOH CO LTD | 1991-08-08 | — | — | JP | disclosed |
| EP-0191970-B1 | RECORDING INFORMATION MEDIA COMPRISING CHROMOPHORES | CELANESE CORPORATION (US) | 1989-09-20 | — | — | EP | disclosed |
| US-4725525-A | Recording information media comprising chromophores | HOEBBST CELANESE CORPORATION (US) | 1988-02-16 | — | — | US | disclosed |
| EP-0191970-A1 | Recording information media comprising chromophores | CELANESE CORPORATION (US) | 1986-08-27 | — | — | EP | disclosed |
| EP-0191215-A2 | Media for optical information storage comprising an organic macrocyclic chromophore substituted with a film conferring organic substituent | CELANESE CORPORATION (US) | 1986-08-20 | — | — | EP | disclosed |