Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 1/20 | 0.51 |
| ▸ | CA9 | Q16790 | 1/20 | 0.51 |
| ▸ | NPC1 | O15118 | 3/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | GAA | P10253 | 2/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | RAB9A | P51151 | 2/20 | 0.43 |
| ▸ | TP53 | P04637 | 1/20 | 0.43 |
| ▸ | ADORA3 | P0DMS8 | 4/20 | 0.40 |
| ▸ | NGFR | P08138 | 1/20 | 0.39 |
| ▸ | TNF | P01375 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 2/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | JAK2 | O60674 | 1/20 | 0.36 |
| ▸ | PAK4 | O96013 | 1/20 | 0.36 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL7649595 | 0.88 | KDM4E (0.47) | NPC1KDM4EALDH1A1GAASMN1; SMN2 | |
| SCHEMBL7651932 | 0.86 | FEN1 (0.51) | KDM4EALDH1A1SMN1; SMN2MAPT | |
| SCHEMBL7649684 | 0.86 | CA12 (0.51) | CA12CA9ALDH1A1SMN1; SMN2MAPT | |
| SCHEMBL7652236 | 0.83 | SMN1; SMN2 (0.55) | CA12CA9NPC1KDM4EALDH1A1 | |
| SCHEMBL7651738 | 0.82 | SMN1; SMN2 (0.43) | CA12CA9NPC1KDM4EALDH1A1 | |
| SCHEMBL7657940 | 0.82 | CA12 (0.55) | CA12CA9KDM4EALDH1A1GAA | |
| SCHEMBL7653151 | 0.81 | KDM4E (0.44) | NPC1KDM4EALDH1A1GAASMN1; SMN2 | |
| SCHEMBL7651849 | 0.81 | MPO (0.38) | NPC1KDM4EALDH1A1GAASMN1; SMN2 | |
| SCHEMBL7648344 | 0.79 | CA9 (0.51) | CA12CA9KDM4EGAAHPGD | |
| SCHEMBL10084842 | 0.75 | KDM4E (0.42) | NPC1KDM4EALDH1A1GAAMAPT |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6407116-B1 | 2,4-DIOXO-1,2,3,4-TETRAHYDROQUINAZOLINE DERIVATIVES; ANTIALLERGENS, ANTIASTHMATICS, ANTIHISTAMINES, AND ANTIINFLAMMATORY AGENTS | TAKEDA CHEMICAL INDUSTRIES, INC. (JP) | 2002-06-18 | — | — | US | disclosed |
| EP-1026160-A1 | NITROGENOUS FUSED-RING COMPOUNDS, PROCESS FOR THE PREPARATION OF THE SAME, AND DRUGS | Takeda Chemical Industries, Ltd. (JP) | 2000-08-09 | — | — | EP | disclosed |