Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LTA4H | P09960 | 1/20 | 0.42 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.42 |
| ▸ | MMP13 | P45452 | 8/20 | 0.40 |
| ▸ | HRH3 | Q9Y5N1 | 3/20 | 0.38 |
| ▸ | FDFT1 | P37268 | 1/20 | 0.34 |
| ▸ | PPARA | Q07869 | 1/20 | 0.34 |
| ▸ | MMP2 | P08253 | 2/20 | 0.34 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.33 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.33 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.33 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.33 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | USP2 | O75604 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | CASP1 | P29466 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL8968667 | 0.97 | LTA4H (0.42) | LTA4HEPHX2MMP13HRH3FDFT1 | |
| SCHEMBL8969873 | 0.82 | MMP13 (0.40) | MMP13FDFT1MMP2 | |
| SCHEMBL8417820 | 0.81 | FDFT1 (0.37) | MMP13FDFT1MMP2 | |
| SCHEMBL27458909 | 0.80 | MMP13 (0.38) | MMP13FDFT1MMP2 | |
| SCHEMBL8772617 | 0.79 | ALDH1A1 (0.46) | LTA4HMMP13HRH3CHRM2CHRM1 | |
| Hydrochloric Acid SCHEMBL8418615 | 0.79 | FDFT1 (0.37) | MMP13FDFT1MMP2KMT2A | |
| SCHEMBL8772717 | 0.78 | SIGMAR1 (0.43) | MMP13HRH3 | |
| SCHEMBL8968633 | 0.77 | CHRM2 (0.39) | MMP13FDFT1MMP2CHRM2CHRM4 | |
| SCHEMBL8707627 | 0.76 | HRH3 (0.42) | LTA4HHRH3CHRM2CHRM4CHRM5 | |
| SCHEMBL8706049 | 0.76 | MMP13 (0.36) | MMP13CHRM2CHRM4CHRM5CHRM1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-1121718-A | Heterocyclic derivatives | ZENECA LTD (GB) | 1996-05-01 | — | — | CN | disclosed |
| EP-0696284-A1 | HETEROCYCLIC DERIVATIVES | ZENECA LIMITED (GB) | 1996-02-14 | — | — | EP | disclosed |
| WO-1994025459-A1 | HETEROCYCLIC DERIVATIVES | ZENECA LIMITED (GB) | 1994-11-10 | — | — | WO | disclosed |