Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CNR2 | P34972 | 6/20 | 0.39 |
| ▸ | CNR1 | P21554 | 4/20 | 0.38 |
| ▸ | TRPA1 | O75762 | 2/20 | 0.38 |
| ▸ | TRPV1 | Q8NER1 | 2/20 | 0.38 |
| ▸ | TRPV3 | Q8NET8 | 2/20 | 0.38 |
| ▸ | TRPV4 | Q9HBA0 | 2/20 | 0.38 |
| ▸ | TRPV2 | Q9Y5S1 | 2/20 | 0.38 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.38 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.38 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.38 |
| ▸ | HTR2A | P28223 | 1/20 | 0.38 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.38 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.38 |
| ▸ | CYP2J2 | P51589 | 1/20 | 0.38 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.38 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.35 |
| ▸ | CYP21A2 | P08686 | 1/20 | 0.35 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL11789000 | 0.84 | CNR1 (0.39) | CNR2CNR1HTR2ASLC6A4CYP17A1 | |
| SCHEMBL11321070 | 0.76 | CNR2 (0.55) | CNR2CNR1TRPA1TRPV1TRPV3 | |
| SCHEMBL11794440 | 0.70 | AKR1B1 (0.37) | CNR2CNR1TRPA1TRPV1TRPV3 | |
| SCHEMBL11787113 | 0.70 | CNR1 (0.38) | CNR2CNR1OPRM1 | |
| SCHEMBL11774583 | 0.69 | CNR2 (0.56) | CNR2CNR1TRPA1TRPV1TRPV3 | |
| SCHEMBL11773119 | 0.67 | CNR2 (0.47) | CNR2CNR1TRPA1TRPV1TRPV3 | |
| SCHEMBL11336618 | 0.67 | CNR2 (0.52) | CNR2CNR1TRPA1TRPV1TRPV3 | |
| SCHEMBL11321088 | 0.66 | CNR2 (0.42) | CNR2CNR1TRPA1TRPV1TRPV3 | |
| SCHEMBL11613806 | 0.65 | CNR2 (0.41) | CNR2CNR1TRPA1TRPV1TRPV3 | |
| SCHEMBL11789592 | 0.65 | ALDH1A1 (0.46) | SLC6A4CYP17A1CYP21A2CYP11B1MAPK14 |
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-3947462-A | 2,4,7-substituted 5-hydroxy benzopyrans and esters | ABBOTT LABORATORIES (US) | 1976-03-30 | — | — | US | claimed |
| US-3947462-A | 2,4,7-substituted 5-hydroxy benzopyrans and esters | ABBOTT LABORATORIES (US) | 1976-03-30 | — | — | US | disclosed |