Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | ESR1 | P03372 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.36 |
| ▸ | NR3C2 | P08235 | 2/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.35 |
| ▸ | DRD2 | P14416 | 1/20 | 0.34 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.34 |
| ▸ | DRD3 | P35462 | 1/20 | 0.34 |
| ▸ | KCNN4 | O15554 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.33 |
| ▸ | CCR6 | P51684 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 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 | |
|---|---|---|---|---|
| SCHEMBL878150 | 0.78 | CYP2C19 (0.38) | CYP2C19HIF1AALDH1A1ESR1CYP3A4 | |
| SCHEMBL8483276 | 0.71 | HIF1A (0.46) | CYP2C19HIF1AALDH1A1ESR1CYP3A4 | |
| SCHEMBL5995232 | 0.70 | MAPT (0.43) | CYP2C19HIF1ANR3C2CYP2D6PTGS2 | |
| SCHEMBL13851677 | 0.69 | HIF1A (0.58) | CYP2C19HIF1AALDH1A1ESR1CYP3A4 | |
| SCHEMBL877144 | 0.69 | MMP12 (0.38) | HIF1AALDH1A1ESR1CYP3A4ESR2 | |
| SCHEMBL27506956 | 0.68 | ALDH1A1 (0.47) | CYP2C19HIF1AALDH1A1ESR1CYP3A4 | |
| SCHEMBL14354913 | 0.67 | KCNN4 (0.52) | ALDH1A1CYP3A4NR3C2CYP2D6MAPK1 | |
| SCHEMBL25009808 | 0.67 | RECQL (0.44) | CYP2C19HIF1AALDH1A1CYP3A4KCNN4 | |
| SCHEMBL173485 | 0.67 | KMT2A (0.44) | CYP2C19HIF1AALDH1A1CYP3A4NR3C2 | |
| SCHEMBL1682512 | 0.67 | HIF1A (0.53) | CYP2C19HIF1AALDH1A1ESR1CYP3A4 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2619179-A1 | MATRIX METALLOPROTEINASE INHIBITORS | Ranbaxy Laboratories Limited (IN) | 2013-07-31 | — | — | EP | claimed |
| WO-2012038944-A1 | MATRIX METALLOPROTEINASE INHIBITORS | RANBAXY LABORATORIES LIMITED (IN) | 2012-03-29 | — | — | WO | claimed |