Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIRT6 | Q8N6T7 | 1/20 | 0.50 |
| ▸ | AKR1C3 | P42330 | 7/20 | 0.49 |
| ▸ | AKR1C2 | P52895 | 7/20 | 0.49 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | PTGS2 | P35354 | 4/20 | 0.44 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.44 |
| ▸ | CDC42 | P60953 | 1/20 | 0.44 |
| ▸ | RAC1 | P63000 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | SLC22A6 | Q4U2R8 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.41 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.41 |
| ▸ | PDGFRA | P16234 | 1/20 | 0.41 |
| ▸ | FLT1 | P17948 | 1/20 | 0.41 |
| ▸ | FGFR3 | P22607 | 1/20 | 0.41 |
| ▸ | KDR | P35968 | 1/20 | 0.41 |
| ▸ | AR | P10275 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL27811747 | 0.84 | SIRT6 (0.51) | SIRT6TDP1MAPTSMN1; SMN2PDGFRB | |
| SCHEMBL2598054 | 0.81 | KMT2A (0.45) | AKR1C3AKR1C2MAPTPTGS2PTGS1 | |
| SCHEMBL2598053 | 0.81 | KMT2A (0.45) | AKR1C3AKR1C2MAPTPTGS2PTGS1 | |
| SCHEMBL11095361 | 0.81 | DTYMK (0.52) | AKR1C3AKR1C2PTGS2PTGS1TSHR | |
| SCHEMBL2954624 | 0.80 | AKR1C3 (0.60) | AKR1C3AKR1C2TDP1PTGS2PTGS1 | |
| SCHEMBL5947600 | 0.80 | AKR1C3 (0.60) | AKR1C3AKR1C2TDP1PTGS2PTGS1 | |
| SCHEMBL7290814 | 0.80 | SIRT6 (0.49) | SIRT6AKR1C3AKR1C2TDP1MAPT | |
| SCHEMBL8803643 | 0.80 | TDP1 (0.49) | SIRT6TDP1MAPTSMN1; SMN2PDGFRB | |
| SCHEMBL2597746 | 0.78 | AKR1C3 (0.58) | AKR1C3AKR1C2MAPTPTGS2PTGS1 | |
| SCHEMBL2597745 | 0.78 | AKR1C3 (0.58) | AKR1C3AKR1C2MAPTPTGS2PTGS1 |
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 |