Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GABRR1 | P24046 | 2/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | BLM | P54132 | 1/20 | 0.38 |
| ▸ | BHMT | Q93088 | 4/20 | 0.38 |
| ▸ | BHMT2 | Q9H2M3 | 1/20 | 0.38 |
| ▸ | ACE2 | Q9BYF1 | 1/20 | 0.36 |
| ▸ | LTA4H | P09960 | 1/20 | 0.35 |
| ▸ | NOS2 | P35228 | 2/20 | 0.32 |
| ▸ | NOS3 | P29474 | 1/20 | 0.32 |
| ▸ | NOS1 | P29475 | 1/20 | 0.32 |
| ▸ | RNPEP | Q9H4A4 | 1/20 | 0.31 |
| ▸ | FOLH1 | Q04609 | 2/20 | 0.31 |
| ▸ | NAALAD2 | Q9Y3Q0 | 2/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL10639397 | 0.82 | GABRR1 (0.42) | GABRR1CYP1A2BLMBHMTBHMT2 | |
| SCHEMBL16555814 | 0.76 | BHMT (0.56) | BHMTBHMT2NOS2NOS3NOS1 | |
| SCHEMBL10636472 | 0.75 | ACE2 (0.47) | GABRR1CYP1A2BLMBHMTBHMT2 | |
| SCHEMBL15681452 | 0.75 | GABRR1 (0.46) | GABRR1CYP1A2BLMBHMTBHMT2 | |
| SCHEMBL11846053 | 0.75 | BHMT (0.55) | GABRR1CYP1A2BLMBHMTBHMT2 | |
| SCHEMBL5139179 | 0.72 | GABRR1 (0.72) | GABRR1CYP1A2BLMACE2LTA4H | |
| SCHEMBL3914127 | 0.72 | GABRR1 (0.43) | GABRR1CYP1A2BLMBHMTBHMT2 | |
| SCHEMBL3914126 | 0.72 | GABRR1 (0.43) | GABRR1CYP1A2BLMBHMTBHMT2 | |
| SCHEMBL3916347 | 0.72 | — | — | |
| SCHEMBL287670 | 0.72 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4990650-A | Lipoxygenase, cyclooxygenase inhibitors | TEIJIN LIMITED (JP) | 1991-02-05 | — | — | US | disclosed |
| EP-0273678-A2 | Aromatic derivative and preparation method thereof | TEIJIN LIMITED (JP) | 1988-07-06 | — | — | EP | disclosed |