Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNN4 | O15554 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | CES1 | P23141 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.38 |
| ▸ | RECQL | P46063 | 1/20 | 0.38 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.38 |
| ▸ | ESR1 | P03372 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.35 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | SSTR4 | P31391 | 1/20 | 0.35 |
| ▸ | MMP2 | P08253 | 1/20 | 0.34 |
| ▸ | MMP13 | P45452 | 1/20 | 0.34 |
| ▸ | ATM | Q13315 | 1/20 | 0.34 |
| ▸ | ELANE | P08246 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL2365012 | 0.85 | MMP2 (0.38) | KCNN4MAPTALDH1A1CYP2C19RECQL | |
| SCHEMBL2364654 | 0.75 | CYP2C19 (0.40) | KCNN4MAPTALDH1A1CYP2C19RECQL | |
| SCHEMBL13931399 | 0.74 | KCNN4 (0.48) | KCNN4MAPTCES1ALDH1A1CYP2C19 | |
| SCHEMBL877144 | 0.72 | MMP12 (0.38) | ALDH1A1HIF1AESR1CYP3A4ESR2 | |
| SCHEMBL28982645 | 0.71 | CES1 (0.42) | KCNN4MAPTCES1ALDH1A1CYP2C19 | |
| SCHEMBL22092188 | 0.69 | KCNN4 (0.51) | KCNN4MAPTCES1ALDH1A1CYP2C19 | |
| SCHEMBL27651289 | 0.68 | KCNN4 (0.46) | KCNN4MAPTCES1ALDH1A1CYP2C19 | |
| SCHEMBL135045 | 0.68 | CES1 (0.54) | KCNN4CES1ALDH1A1CYP2C19HIF1A | |
| SCHEMBL1682512 | 0.68 | HIF1A (0.53) | KCNN4MAPTALDH1A1CYP2C19HIF1A | |
| SCHEMBL75391 | 0.68 | ALDH1A1 (0.72) | KCNN4MAPTALDH1A1CYP2C19HIF1A |
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 |
|---|---|---|---|---|---|---|---|
| WO-2011092284-A1 | NOVEL AMINO ACID DERIVATIVES AND THEIR USE AS GPR43 RECEPTOR MODULATORS | EUROSCREEN S.A. (BE) | 2011-08-04 | — | — | WO | disclosed |