Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.49 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.49 |
| ▸ | MGLL | Q99685 | 1/20 | 0.49 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.45 |
| ▸ | CA12 | O43570 | 1/20 | 0.45 |
| ▸ | CA1 | P00915 | 1/20 | 0.45 |
| ▸ | CA4 | P22748 | 1/20 | 0.45 |
| ▸ | CA6 | P23280 | 1/20 | 0.45 |
| ▸ | CA5A | P35218 | 1/20 | 0.45 |
| ▸ | CA7 | P43166 | 1/20 | 0.45 |
| ▸ | CA9 | Q16790 | 1/20 | 0.45 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.45 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.42 |
| ▸ | HPGD | P15428 | 4/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | BLM | P54132 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL1922500 | 0.88 | KDM4E (0.44) | KDM4EHSD17B10MGLLTDP1CYP1A2 | |
| SCHEMBL29957761 | 0.88 | MAOB (0.48) | KDM4EHSD17B10MGLLTDP1CA12 | |
| SCHEMBL12269272 | 0.88 | MAOB (0.51) | KDM4EHSD17B10MGLLTDP1CA12 | |
| SCHEMBL17541501 | 0.85 | KDM4E (0.46) | KDM4EHSD17B10MGLLTDP1CA12 | |
| SCHEMBL2963271 | 0.82 | KDM4E (0.53) | KDM4EHSD17B10MGLLTDP1CA12 | |
| SCHEMBL17541467 | 0.82 | CA12 (0.48) | KDM4EHSD17B10MGLLTDP1CA12 | |
| SCHEMBL1602546 | 0.80 | KDM4E (0.44) | KDM4EHSD17B10MGLLTDP1MAOB | |
| SCHEMBL10025750 | 0.79 | MAOB (0.36) | KDM4EHSD17B10MGLLTDP1CYP1A2 | |
| SCHEMBL1602246 | 0.77 | S1PR1 (0.46) | KDM4EHSD17B10MGLLTDP1MAOB | |
| SCHEMBL29000615 | 0.77 | KDM4E (0.42) | KDM4EHSD17B10MGLLTDP1CA12 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2016000599-A1 | C-BENZO FIVE-MEMBERED HETEROAROMATIC RING ARYL GLUCOSIDE DERIVATIVE AND PREPARATION METHOD THEREFOR AND USE THEREOF | 上海阳帆医药科技有限公司 | 2016-01-07 | — | — | WO | disclosed |