Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM5 | P08912 | 1/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | FBP1 | P09467 | 2/20 | 0.40 |
| ▸ | CHAT | P28329 | 1/20 | 0.40 |
| ▸ | PNMT | P11086 | 1/20 | 0.39 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.39 |
| ▸ | GRIN1 | Q05586 | 3/20 | 0.39 |
| ▸ | GRIN2B | Q13224 | 3/20 | 0.39 |
| ▸ | GRIN2D | O15399 | 2/20 | 0.39 |
| ▸ | GRIN3B | O60391 | 2/20 | 0.39 |
| ▸ | GRIN2A | Q12879 | 2/20 | 0.39 |
| ▸ | GRIN2C | Q14957 | 2/20 | 0.39 |
| ▸ | GRIN3A | Q8TCU5 | 2/20 | 0.39 |
| ▸ | RELA | Q04206 | 1/20 | 0.39 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.38 |
| ▸ | HTR3B | O95264 | 1/20 | 0.38 |
| ▸ | HTR3A | P46098 | 1/20 | 0.38 |
| ▸ | HTR3D | Q70Z44 | 1/20 | 0.38 |
| ▸ | HTR3C | Q8WXA8 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL27787151 | 0.89 | GRIN2B (0.48) | CHRM5CYP1A2CYP2C9PNMTTAAR1 | |
| SCHEMBL6031658 | 0.86 | CHRM5 (0.53) | CHRM5CYP1A2CYP2C9PNMTTAAR1 | |
| SCHEMBL27629821 | 0.84 | TLR4 (0.33) | CHRM5CYP1A2CYP2C9TAAR1GRIN1 | |
| SCHEMBL28688634 | 0.83 | KMT2A (0.48) | CHRM5CYP1A2CYP2C9FBP1CHAT | |
| SCHEMBL8840747 | 0.82 | SIGMAR1 (0.44) | CYP1A2GRIN1GRIN2BMAOBMAPT | |
| SCHEMBL27927705 | 0.81 | PNMT (0.48) | CHRM5PNMTTAAR1GRIN2BHTR3E | |
| SCHEMBL3653593 | 0.80 | KDM4E (0.51) | CHRM5RELANPC1RAB9A | |
| SCHEMBL9330295 | 0.80 | RELA (0.57) | RELAMAPTTP53POLBNPC1 | |
| SCHEMBL9588199 | 0.79 | HSD17B10 (0.50) | TAAR1MAOBMAPTNPC1RAB9A | |
| SCHEMBL19437176 | 0.79 | MEN1 (0.43) | CYP1A2CYP2C9MAOAMAOBMAPT |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2008005565-A9 | ANTIVIRAL PHOSPHINATE COMPOUNDS | GILEAD SCIENCES INC (US) | 2009-01-29 | — | — | WO | disclosed |