Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CNR2 | P34972 | 12/20 | 0.52 |
| ▸ | CNR1 | P21554 | 10/20 | 0.52 |
| ▸ | OPRM1 | P35372 | 4/20 | 0.39 |
| ▸ | TRPA1 | O75762 | 2/20 | 0.39 |
| ▸ | TRPV1 | Q8NER1 | 2/20 | 0.39 |
| ▸ | TRPV3 | Q8NET8 | 2/20 | 0.39 |
| ▸ | TRPV4 | Q9HBA0 | 2/20 | 0.39 |
| ▸ | TRPV2 | Q9Y5S1 | 2/20 | 0.39 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.39 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.39 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.39 |
| ▸ | HTR2A | P28223 | 1/20 | 0.39 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.39 |
| ▸ | CYP2J2 | P51589 | 1/20 | 0.39 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL11741318 | 0.86 | CNR2 (0.62) | CNR2CNR1OPRM1TRPA1TRPV1 | |
| SCHEMBL11738826 | 0.85 | CNR2 (0.63) | CNR2CNR1OPRM1TRPA1TRPV1 | |
| SCHEMBL11734846 | 0.85 | CNR2 (0.63) | CNR2CNR1OPRM1TRPA1TRPV1 | |
| SCHEMBL11740634 | 0.83 | CNR2 (0.46) | CNR2CNR1OPRM1TRPA1TRPV1 | |
| SCHEMBL11328812 | 0.78 | CNR2 (0.56) | CNR2CNR1OPRM1TRPA1TRPV1 | |
| SCHEMBL11739040 | 0.78 | CNR2 (0.51) | CNR2CNR1OPRM1TRPA1TRPV1 | |
| SCHEMBL11736546 | 0.77 | CNR2 (0.39) | CNR2CNR1MEN1GAAKMT2A | |
| SCHEMBL11741078 | 0.76 | CNR2 (0.76) | CNR2CNR1OPRM1TRPA1TRPV1 | |
| Hydrochloric Acid SCHEMBL11737670 | 0.75 | CNR2 (0.35) | CNR2CNR1 | |
| SCHEMBL11734034 | 0.75 | CNR2 (0.56) | CNR2CNR1OPRM1TRPA1TRPV1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4025630-A | Anesthesia methods using benzopyrans and esters thereof as pre-anesthesia medication | ABBOTT LABORATORIES (US) | 1977-05-24 | — | — | US | disclosed |
| US-3972880-A | TRANQUILIZER | SHARPS ASSOCIATES (US) | 1976-08-03 | — | — | US | disclosed |
| US-3960871-A | ANTIDEPRESSANT, ANALGESICS, ANTICONVULSANT ANTI-ANXIETY ACTIVITY | SHARPS ASSOCIATES (US) | 1976-06-01 | — | — | US | disclosed |
| US-3940421-A | Intermediates for the preparation of thienobenzopyrans and thiopyranobenzopyrans | ARTHUR D. LITTLE, INC. (US) | 1976-02-24 | — | — | US | disclosed |