Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MMP13 | P45452 | 2/20 | 0.41 |
| ▸ | MMP2 | P08253 | 1/20 | 0.41 |
| ▸ | MMP8 | P22894 | 1/20 | 0.41 |
| ▸ | DRD2 | P14416 | 3/20 | 0.39 |
| ▸ | DRD3 | P35462 | 3/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | EPHX2 | P34913 | 2/20 | 0.36 |
| ▸ | GRM2 | Q14416 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | MMP1 | P03956 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 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 | |
|---|---|---|---|---|
| SCHEMBL6968315 | 0.77 | CYP4F2 (0.45) | MMP13EPHX2KMT2AMMP1 | |
| SCHEMBL6976704 | 0.76 | MMP1 (0.40) | MMP13KDM4EEPHX2KMT2AMMP1 | |
| SCHEMBL6735747 | 0.75 | CHRNB2 (0.42) | MMP13MMP2MMP8DRD2DRD3 | |
| SCHEMBL6972751 | 0.69 | CYP4F2 (0.37) | DRD2DRD3EPHX2KMT2A | |
| SCHEMBL6829624 | 0.66 | CHRNB2 (0.41) | EPHX2 | |
| SCHEMBL6827826 | 0.65 | CYP4F2 (0.43) | MMP13MMP2MMP8MMP1ALDH1A1 | |
| SCHEMBL918530 | 0.65 | CHRNB2 (0.53) | KMT2AHTT | |
| SCHEMBL16198444 | 0.63 | LMNA (0.54) | DRD2DRD3KMT2A | |
| SCHEMBL6735054 | 0.61 | MMP13 (0.52) | MMP13MMP2MMP8MMP1ALDH1A1 | |
| SCHEMBL629943 | 0.61 | NPC1 (0.47) | KDM4EKMT2AALDH1A1GAAMEN1 |
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 |
|---|---|---|---|---|---|---|---|
| US-6680338-B2 | MATRIX METALLOPROTEINASE AND TUMOR NECROSIS FACTOR INHIBITORS; ANTICARCINOGENIC AGENTS; RHEUMATOID ARTHRITIS | DARWIN DISCOVERY LTD. (GB) | 2004-01-20 | — | — | US | disclosed |