Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.47 |
| ▸ | ALDH2 | P05091 | 1/20 | 0.45 |
| ▸ | ALDH3A1 | P30838 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 3/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.45 |
| ▸ | TSHR | P16473 | 2/20 | 0.45 |
| ▸ | RECQL | P46063 | 2/20 | 0.45 |
| ▸ | USP2 | O75604 | 1/20 | 0.45 |
| ▸ | HPGD | P15428 | 1/20 | 0.45 |
| ▸ | CASP1 | P29466 | 1/20 | 0.45 |
| ▸ | CASP7 | P55210 | 1/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.45 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.44 |
| ▸ | CES1 | P23141 | 2/20 | 0.44 |
| ▸ | HTT | P42858 | 2/20 | 0.44 |
| ▸ | CDC25A | P30304 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL2665904 | 0.82 | CHRM2 (0.64) | KDM4ECHRM2NPC1RAB9A | |
| SCHEMBL8658770 | 0.81 | ALDH1A1 (0.62) | KDM4EALDH1A1MAPK1HSD17B10ALDH2 | |
| SCHEMBL11878800 | 0.81 | HSD17B10 (0.64) | KDM4EALDH1A1MAPK1HSD17B10ALDH2 | |
| SCHEMBL3027498 | 0.80 | ALDH1A1 (0.64) | ALDH1A1ALDH2ALDH3A1MEN1KMT2A | |
| SCHEMBL2892202 | 0.79 | CNR2 (0.50) | — | |
| SCHEMBL12979075 | 0.79 | ALDH1A1 (0.60) | KDM4EALDH1A1MAPK1HSD17B10ALDH2 | |
| SCHEMBL145135 | 0.79 | ALDH1A1 (0.60) | KDM4EALDH1A1MAPK1HSD17B10ALDH2 | |
| SCHEMBL14560519 | 0.79 | HSD17B10 (0.62) | KDM4EALDH1A1MAPK1HSD17B10MEN1 | |
| SCHEMBL10451307 | 0.79 | ACHE (0.49) | KDM4EALDH1A1MEN1KMT2ATSHR | |
| SCHEMBL10451411 | 0.79 | CNR2 (0.50) | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-1147475-C | Process for preparation of anti-malarial drugs | ʷ | 2004-04-28 | — | — | CN | disclosed |
| CN-1199395-A | Process for preparing antimalarial drugs | SMITHKLINE BEECHAM PLC (GB) | 1998-11-18 | — | — | CN | disclosed |
| EP-0871616-A1 | PROCESS FOR THE PREPARATION OF ANTI-MALARIAL DRUGS | SMITHKLINE BEECHAM PLC (GB) | 1998-10-21 | — | — | EP | disclosed |
| WO-1997013753-A1 | PROCESS FOR THE PREPARATION OF ANTI-MALARIAL DRUGS | SMITHKLINE BEECHAM P.L.C. (GB) | 1997-04-17 | — | — | WO | disclosed |