Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 1/20 | 0.43 |
| ▸ | CA9 | Q16790 | 1/20 | 0.43 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.37 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.37 |
| ▸ | XDH | P47989 | 1/20 | 0.37 |
| ▸ | ABCB1 | P08183 | 11/20 | 0.35 |
| ▸ | KCNE1 | P15382 | 3/20 | 0.35 |
| ▸ | KCNQ1 | P51787 | 3/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | KCND3 | Q9UK17 | 1/20 | 0.35 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL8534981 | 0.84 | CA12 (0.40) | CA12CA9PTGS1PTGS2XDH | |
| SCHEMBL30523681 | 0.80 | CA12 (0.46) | CA12CA9PTGS1PTGS2XDH | |
| SCHEMBL506743 | 0.80 | CA12 (0.46) | CA12CA9PTGS1PTGS2XDH | |
| SCHEMBL9206139 | 0.74 | CA12 (0.40) | CA12CA9PTGS1PTGS2XDH | |
| SCHEMBL6980284 | 0.74 | CA12 (0.40) | CA12CA9PTGS1PTGS2XDH | |
| SCHEMBL9736524 | 0.74 | PTGS1 (0.46) | CA12CA9PTGS1PTGS2XDH | |
| SCHEMBL10511983 | 0.72 | HTR2C (0.45) | PTGS1PTGS2XDHMEN1KMT2A | |
| SCHEMBL9876173 | 0.72 | HTR2C (0.49) | CA12CA9ABCB1 | |
| SCHEMBL7298872 | 0.72 | KCNE1 (0.37) | CA12CA9ABCB1KCNE1KCNQ1 | |
| SCHEMBL20766474 | 0.70 | ODC1 (0.44) | CA12CA9XDHABCB1KCNE1 |
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-5071871-A | Pharmaceutically useful benzo(β)pyranes and pyranopyridines | SANDOZ LTD. (CH) | 1991-12-10 | — | — | US | disclosed |
| US-4988723-A | Hypotensive agents, vasodilation | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 1991-01-29 | — | — | US | disclosed |
| CN-1038811-A | 1-benzopyran derivatives and preparation method thereof | FUJISAWA PHARMACEUTICAL CO (JP) | 1990-01-17 | — | — | CN | disclosed |
| EP-0344747-A1 | Benzopyran derivatives and processes for preparation thereof | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 1989-12-06 | — | — | EP | disclosed |