Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 3/20 | 0.64 |
| ▸ | ACHE | P22303 | 1/20 | 0.61 |
| ▸ | L3MBTL3 | Q96JM7 | 3/20 | 0.60 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.60 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.57 |
| ▸ | USP2 | O75604 | 1/20 | 0.57 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.56 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.56 |
| ▸ | POLB | P06746 | 1/20 | 0.56 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.54 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.54 |
| ▸ | MEN1 | O00255 | 2/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.54 |
| ▸ | TSHR | P16473 | 1/20 | 0.54 |
| ▸ | SLC18A3 | Q16572 | 1/20 | 0.52 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.52 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.51 |
| ▸ | MGLL | Q99685 | 1/20 | 0.51 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL409005 | 0.93 | ACHE (0.69) | HPGDACHEL3MBTL3L3MBTL1ALDH1A1 | |
| Hydrochloric Acid SCHEMBL4618202 | 0.92 | ACHE (0.67) | HPGDACHEL3MBTL3L3MBTL1ALDH1A1 | |
| SCHEMBL3314769 | 0.87 | HPGD (0.59) | HPGDACHEL3MBTL3L3MBTL1ALDH1A1 | |
| SCHEMBL3314775 | 0.87 | HPGD (0.59) | HPGDACHEL3MBTL3L3MBTL1ALDH1A1 | |
| SCHEMBL27970474 | 0.87 | HPGD (0.59) | HPGDACHEL3MBTL3L3MBTL1ALDH1A1 | |
| Hydrochloric Acid SCHEMBL30708065 | 0.86 | HPGD (0.57) | HPGDACHEL3MBTL3L3MBTL1ALDH1A1 | |
| Trifluoroacetic Acid SCHEMBL5146749 | 0.84 | ACHE (0.58) | HPGDACHEL3MBTL3L3MBTL1EPHX1 | |
| SCHEMBL1136719 | 0.84 | L3MBTL3 (0.59) | HPGDACHEL3MBTL3L3MBTL1ALDH1A1 | |
| SCHEMBL2130912 | 0.83 | ACHE (0.60) | HPGDACHEL3MBTL3L3MBTL1EPHX1 | |
| Hydrochloric Acid SCHEMBL1136918 | 0.83 | L3MBTL3 (0.58) | HPGDACHEL3MBTL3L3MBTL1ALDH1A1 |
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-2008039420-A2 | NOVEL INHIBITORS OF BETA-LACTAMASE | MERCK & CO., INC. (US) | 2008-04-03 | — | — | WO | disclosed |