Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GABRR1 | P24046 | 2/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | BLM | P54132 | 1/20 | 0.37 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | BHMT | Q93088 | 4/20 | 0.37 |
| ▸ | BHMT2 | Q9H2M3 | 1/20 | 0.37 |
| ▸ | ACE2 | Q9BYF1 | 1/20 | 0.35 |
| ▸ | LTA4H | P09960 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | NOS2 | P35228 | 2/20 | 0.31 |
| ▸ | NOS3 | P29474 | 1/20 | 0.31 |
| ▸ | NOS1 | P29475 | 1/20 | 0.31 |
| ▸ | RNPEP | Q9H4A4 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL9863044 | 0.82 | GABRR1 (0.43) | GABRR1CYP1A2BLMBHMTBHMT2 | |
| SCHEMBL10311774 | 0.80 | MEN1 (0.36) | ALOX5SMN1; SMN2 | |
| SCHEMBL2350703 | 0.80 | ALOX5 (0.40) | GABRR1CYP1A2BLMALOX5SMN1; SMN2 | |
| SCHEMBL159086 | 0.80 | ALOX5 (0.40) | GABRR1CYP1A2BLMALOX5SMN1; SMN2 | |
| SCHEMBL10636270 | 0.79 | SLC1A3 (0.41) | ALOX5SMN1; SMN2BHMTBHMT2RNPEP | |
| SCHEMBL2730007 | 0.78 | TET2 (0.40) | ALOX5SMN1; SMN2BHMTBHMT2 | |
| SCHEMBL3435788 | 0.77 | BHMT (0.55) | BHMTBHMT2NOS2NOS3NOS1 | |
| SCHEMBL15285691 | 0.77 | BHMT (0.55) | BHMTBHMT2NOS2NOS3NOS1 | |
| SCHEMBL15285694 | 0.77 | BHMT (0.55) | BHMTBHMT2NOS2NOS3NOS1 | |
| SCHEMBL32674538 | 0.77 | ALOX5 (0.33) | ALOX5SMN1; SMN2 |
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-4739105-A | ORGANOLEPTIC | INTERNATIONAL FLAVORS & FRANGRANCES INC. (US) | 1988-04-19 | — | — | US | disclosed |
| US-4631194-A | ORGANOLEPTIC | INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) | 1986-12-23 | — | — | US | disclosed |