Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NQO1 | P15559 | 1/20 | 0.61 |
| ▸ | CA12 | O43570 | 2/20 | 0.58 |
| ▸ | CA1 | P00915 | 2/20 | 0.58 |
| ▸ | CA9 | Q16790 | 2/20 | 0.58 |
| ▸ | KCNA3 | P22001 | 1/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.54 |
| ▸ | MEN1 | O00255 | 1/20 | 0.54 |
| ▸ | TP53 | P04637 | 1/20 | 0.54 |
| ▸ | TSHR | P16473 | 1/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.54 |
| ▸ | MAOB | P27338 | 1/20 | 0.49 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.47 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.47 |
| ▸ | MAOA | P21397 | 2/20 | 0.46 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.46 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.46 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.45 |
| ▸ | GLA | P06280 | 1/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL1627582 | 0.81 | CYP2A6 (0.64) | NQO1CA12CA1CA9KCNA3 | |
| SCHEMBL15842820 | 0.79 | CA12 (0.55) | NQO1CA12CA1CA9KCNA3 | |
| SCHEMBL31236780 | 0.79 | CA12 (0.55) | NQO1CA12CA1CA9KCNA3 | |
| SCHEMBL8644443 | 0.79 | KCNA3 (0.66) | NQO1CA12CA1CA9KCNA3 | |
| SCHEMBL3911837 | 0.78 | KCNA3 (0.69) | NQO1CA12CA1CA9KCNA3 | |
| SCHEMBL15843118 | 0.77 | PTGS2 (0.59) | NQO1CA12CA1CA9KCNA3 | |
| SCHEMBL15864643 | 0.77 | NQO1 (0.56) | NQO1CA12CA1CA9KCNA3 | |
| SCHEMBL15398161 | 0.77 | CA12 (0.54) | NQO1CA12CA1CA9KCNA3 | |
| SCHEMBL15842782 | 0.77 | CYP2A6 (0.67) | NQO1CA12CA1CA9KCNA3 | |
| Hydrochloric Acid SCHEMBL31460826 | 0.77 | KCNA3 (0.68) | NQO1CA12CA1CA9KCNA3 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-9353390-B2 | Genetically engineered microbes and methods for producing 4-hydroxycoumarin | UNIVERSITY OF GEORGIA RESEARCH FOUNDATION, INC. (US) | 2016-05-31 | — | — | US | disclosed |