Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 2/20 | 0.46 |
| ▸ | CDK4 | P11802 | 2/20 | 0.45 |
| ▸ | CCND1 | P24385 | 2/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | GLA | P06280 | 1/20 | 0.35 |
| ▸ | PARP1 | P09874 | 4/20 | 0.35 |
| ▸ | TNKS2 | Q9H2K2 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | USP2 | O75604 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | CCNE2 | O96020 | 1/20 | 0.35 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.35 |
| ▸ | CDK2 | P24941 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.33 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.33 |
| ▸ | BACE1 | P56817 | 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 | |
|---|---|---|---|---|
| SCHEMBL12176674 | 0.89 | HTT (0.43) | HTTCDK4CCND1ALDH1A1L3MBTL1 | |
| SCHEMBL20990600 | 0.81 | POLB (0.52) | HTTCDK4CCND1ALDH1A1L3MBTL1 | |
| SCHEMBL9879082 | 0.78 | HTT (0.77) | HTTALDH1A1L3MBTL1HPGDUSP2 | |
| SCHEMBL19503753 | 0.78 | CDK4 (0.39) | HTTCDK4CCND1ALDH1A1L3MBTL1 | |
| SCHEMBL5851856 | 0.74 | SMPD3 (0.34) | CDK4CCND1ALDH1A1GLAPOLB | |
| SCHEMBL3704415 | 0.72 | PDK2 (0.37) | CDK4CCND1ALDH1A1GLAUSP2 | |
| SCHEMBL4128983 | 0.72 | PDE2A (0.40) | CDK4CCND1ALDH1A1L3MBTL1GLA | |
| SCHEMBL8459493 | 0.71 | KDM4E (0.34) | CDK4CCND1ALDH1A1USP2POLB | |
| SCHEMBL3845619 | 0.70 | PDE5A (0.62) | ALDH1A1HPGDPOLBPDE3BPDE3A | |
| SCHEMBL172127 | 0.69 | ALDH1A1 (0.58) | ALDH1A1L3MBTL1MAPK1GLAPARP1 |
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-2017184999-A1 | EZH2 INHIBITORS AND USES THEREOF | DANA-FARBER CANCER INSTITUTE, INC. (US) | 2017-10-26 | — | — | WO | disclosed |