Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A1 | P04798 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.39 |
| ▸ | ASIC3 | Q9UHC3 | 1/20 | 0.37 |
| ▸ | NCEH1 | Q6PIU2 | 2/20 | 0.36 |
| ▸ | GRM5 | P41594 | 1/20 | 0.36 |
| ▸ | PLAU | P00749 | 1/20 | 0.35 |
| ▸ | TRPV3 | Q8NET8 | 1/20 | 0.33 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.33 |
| ▸ | CNR1 | P21554 | 1/20 | 0.33 |
| ▸ | CNR2 | P34972 | 1/20 | 0.33 |
| ▸ | ACACB | O00763 | 2/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
| ▸ | PKM | P14618 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.32 |
| ▸ | FFAR4 | Q5NUL3 | 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 | |
|---|---|---|---|---|
| SCHEMBL8080953 | 0.93 | ASIC3 (0.43) | ASIC3GRM5PLAUTRPV3HRH3 | |
| SCHEMBL5683348 | 0.90 | CYP1A1 (0.38) | CYP1A1CYP1A2CYP1B1ASIC3NCEH1 | |
| SCHEMBL14526040 | 0.88 | FFAR1 (0.34) | ASIC3NCEH1GRM5TRPV3HRH3 | |
| SCHEMBL5684753 | 0.88 | NCEH1 (0.42) | CYP1A1CYP1A2CYP1B1ASIC3NCEH1 | |
| SCHEMBL5687526 | 0.88 | NCEH1 (0.39) | CYP1A1CYP1A2CYP1B1ASIC3NCEH1 | |
| SCHEMBL5686514 | 0.87 | ASIC3 (0.41) | CYP1A1CYP1A2CYP1B1ASIC3NCEH1 | |
| SCHEMBL5684115 | 0.86 | CYP1A1 (0.39) | CYP1A1CYP1A2CYP1B1ASIC3NCEH1 | |
| SCHEMBL5684156 | 0.85 | KIF11 (0.36) | CYP1A1CYP1A2CYP1B1ASIC3NCEH1 | |
| SCHEMBL5684673 | 0.85 | CYP1A1 (0.35) | CYP1A1CYP1A2CYP1B1ASIC3NCEH1 | |
| SCHEMBL8080954 | 0.85 | CHAT (0.37) | CYP1A1CYP1A2CYP1B1NCEH1GRM5 |
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-7067179-B1 | Fused ring compound | DAINIPPON INK AND CHEMICALS, INC. (JP) | 2006-06-27 | — | — | US | disclosed |
| EP-1201632-B1 | FUSED RING COMPOUND | DAINIPPON INK & CHEMICALS (JP) | 2006-03-29 | — | — | EP | disclosed |
| EP-1201632-A1 | FUSED RING COMPOUND | DAINIPPON INK AND CHEMICALS, INC. (JP) | 2002-05-02 | — | — | EP | disclosed |