Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA9 | Q16790 | 11/20 | 0.83 |
| ▸ | CA12 | O43570 | 10/20 | 0.83 |
| ▸ | CA1 | P00915 | 10/20 | 0.83 |
| ▸ | CA6 | P23280 | 5/20 | 0.83 |
| ▸ | CA7 | P43166 | 5/20 | 0.83 |
| ▸ | CA14 | Q9ULX7 | 5/20 | 0.83 |
| ▸ | CA4 | P22748 | 5/20 | 0.83 |
| ▸ | CA5B | Q9Y2D0 | 3/20 | 0.83 |
| ▸ | CA5A | P35218 | 3/20 | 0.83 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.83 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.66 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.66 |
| ▸ | HPGD | P15428 | 3/20 | 0.66 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.66 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.66 |
| ▸ | MEN1 | O00255 | 2/20 | 0.66 |
| ▸ | AKR1B1 | P15121 | 2/20 | 0.66 |
| ▸ | GLA | P06280 | 1/20 | 0.66 |
| ▸ | GAA | P10253 | 1/20 | 0.66 |
| ▸ | CASP1 | P29466 | 1/20 | 0.66 |
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 | |
|---|---|---|---|---|
| Ethoxycoumarin SCHEMBL119072 | 0.91 | CA9 (1.00) | CA9CA12CA1CA6CA7 | |
| SCHEMBL21647395 | 0.81 | MAOB (0.77) | CA9CA12CA1CA6CA7 | |
| Umbelliferone SCHEMBL22018 | 0.81 | CA9 (1.00) | CA9CA12CA1CA6CA7 | |
| Umbelliferone SCHEMBL11137587 | 0.81 | CA9 (1.00) | CA9CA12CA1CA6CA7 | |
| Umbelliferone SCHEMBL29624448 | 0.81 | CA9 (1.00) | CA9CA12CA1CA6CA7 | |
| Umbelliferone SCHEMBL29396070 | 0.81 | CA9 (1.00) | CA9CA12CA1CA6CA7 | |
| SCHEMBL11036182 | 0.80 | CA9 (0.79) | CA9CA12CA1CA6CA7 | |
| SCHEMBL19194269 | 0.79 | CA12 (0.77) | CA9CA12CA1CA6CA7 | |
| Umbelliferone SCHEMBL2767044 | 0.79 | CA9 (0.96) | CA9CA12CA1CA6CA7 | |
| Umbelliferone SCHEMBL307982 | 0.79 | CA9 (0.96) | CA9CA12CA1CA6CA7 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0419567-A1 | PROCESS FOR INDUCING CYTOCHROME P-450 ENZYMES IN STREPTOMYCES-BACTERIA AND DETERMINING THE MUTAGENICITY OF CHEMICALS. | DU PONT (US) | 1991-04-03 | — | — | EP | disclosed |
| WO-1989012686-A1 | PROCESS FOR INDUCING CYTOCHROME P-450 ENZYMES IN STREPTOMYCES BACTERIA AND DETERMINING THE MUTAGENICITY OF CHEMICALS | E.I. DU PONT DE NEMOURS AND COMPANY (US) | 1989-12-28 | — | — | WO | disclosed |