Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ELANE | P08246 | 3/20 | 0.51 |
| ▸ | CA2 | P00918 | 6/20 | 0.50 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | KDM1A | O60341 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | NR1H4 | Q96RI1 | 2/20 | 0.36 |
| ▸ | ATM | Q13315 | 1/20 | 0.36 |
| ▸ | MPL | P40238 | 1/20 | 0.36 |
| ▸ | CA12 | O43570 | 3/20 | 0.35 |
| ▸ | CA1 | P00915 | 3/20 | 0.35 |
| ▸ | CA9 | Q16790 | 3/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | EGFR | P00533 | 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 | |
|---|---|---|---|---|
| SCHEMBL343614 | 0.81 | CYP3A4 (0.51) | CA2LMNAHPGDHIF1AHSD17B10 | |
| SCHEMBL4622585 | 0.80 | ELANE (0.56) | ELANECA2KDM1AALDH1A1NR1H4 | |
| SCHEMBL344749 | 0.80 | CYP3A4 (0.50) | CA2LMNAHPGDHIF1AHSD17B10 | |
| SCHEMBL4061539 | 0.77 | ELANE (0.65) | ELANECA2LMNAHPGDHIF1A | |
| SCHEMBL4061370 | 0.76 | ELANE (0.81) | ELANECA2LMNAKDM1AMAPT | |
| SCHEMBL2336447 | 0.75 | ERN1 (0.50) | CA2LMNAHPGDHIF1AHSD17B10 | |
| SCHEMBL4641620 | 0.75 | ELANE (0.54) | ELANECA2LMNAHSD17B10KDM1A | |
| SCHEMBL10785102 | 0.74 | MPL (0.49) | CA2LMNAHPGDHIF1AHSD17B10 | |
| SCHEMBL4057059 | 0.73 | ELANE (0.70) | ELANECA2KDM1AMAPT | |
| SCHEMBL6392035 | 0.72 | CYP3A4 (0.62) | ELANECA2LMNAKDM1AALDH1A1 |
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-2008113863-A2 | NITROSATED DERIVATIVES OF 2,5-DIHYDROXYBENZENE COMPOUNDS | ACTION MEDICINES, S.L. (ES) | 2008-09-25 | — | — | WO | disclosed |