Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | STK17A | Q9UEE5 | 2/20 | 0.37 |
| ▸ | CSNK1A1 | P48729 | 1/20 | 0.36 |
| ▸ | CSNK1D | P48730 | 1/20 | 0.36 |
| ▸ | CSNK1E | P49674 | 1/20 | 0.36 |
| ▸ | CSNK1G2 | P78368 | 1/20 | 0.36 |
| ▸ | CSNK1G1 | Q9HCP0 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 2/20 | 0.35 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 3/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | GLA | P06280 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | P2RX7 | Q99572 | 2/20 | 0.33 |
| ▸ | HTT | P42858 | 2/20 | 0.33 |
| ▸ | FERMT2 | Q96AC1 | 1/20 | 0.33 |
| ▸ | CDK5 | Q00535 | 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 | |
|---|---|---|---|---|
| SCHEMBL11240997 | 0.76 | CYP1A2 (0.38) | STK17ACSNK1A1GAAMAPTKDM4E | |
| SCHEMBL11235154 | 0.76 | TAAR1 (0.46) | CSNK1A1MAPTKDM4EMEN1ALDH1A1 | |
| SCHEMBL28585046 | 0.71 | MAPT (0.35) | GAAMAPTKMT2AP2RX7CYP1A2 | |
| SCHEMBL19986470 | 0.71 | MAPT (0.38) | GAAMAPTKDM4EMEN1ALDH1A1 | |
| SCHEMBL1665457 | 0.69 | MAPT (0.42) | GAAMAPTKDM4EMEN1ALDH1A1 | |
| SCHEMBL11217431 | 0.69 | CA12 (0.33) | KDM4EMEN1ALDH1A1KMT2ATDP1 | |
| SCHEMBL28571392 | 0.67 | P2RX7 (0.32) | P2RX7 | |
| Hydrochloric Acid SCHEMBL28300035 | 0.67 | MRGPRX4 (0.35) | GAAMAPTMEN1ALDH1A1KMT2A | |
| SCHEMBL6221844 | 0.67 | P2RX7 (0.43) | KDM4CMEN1KMT2AP2RX7CYP2D6 | |
| SCHEMBL19986728 | 0.66 | — | — |
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-2018050110-A1 | NOVEL CAPSID PROTEIN ASSEMBLY INHIBITOR | 正大天晴药业集团股份有限公司 | 2018-03-22 | — | — | WO | disclosed |