Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KIF11 | P52732 | 3/20 | 0.46 |
| ▸ | USP2 | O75604 | 3/20 | 0.45 |
| ▸ | PKM | P14618 | 2/20 | 0.45 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.45 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.45 |
| ▸ | RECQL | P46063 | 2/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.45 |
| ▸ | RGS12 | O14924 | 1/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.45 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.45 |
| ▸ | CASP1 | P29466 | 1/20 | 0.45 |
| ▸ | BRCA1 | P38398 | 1/20 | 0.45 |
| ▸ | THPO | P40225 | 1/20 | 0.45 |
| ▸ | CASP7 | P55210 | 1/20 | 0.45 |
| ▸ | GNAI1 | P63096 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL27535126 | 0.85 | ALOX15 (0.51) | USP2PKMALOX15HIF1AHSD17B10 | |
| SCHEMBL9513810 | 0.85 | ALOX15 (0.51) | USP2PKMALOX15HIF1AHSD17B10 | |
| SCHEMBL6584398 | 0.85 | ALOX15 (0.51) | USP2PKMALOX15HIF1AHSD17B10 | |
| SCHEMBL8525825 | 0.83 | ATM (0.36) | KIF11MEN1ALDH1A1LMNAKMT2A | |
| SCHEMBL23581846 | 0.80 | NOS3 (0.55) | KIF11USP2PKMALOX15HIF1A | |
| SCHEMBL1312888 | 0.79 | GRB2 (0.54) | KIF11USP2PKMALOX15HIF1A | |
| SCHEMBL1312890 | 0.79 | GRB2 (0.54) | KIF11USP2PKMALOX15HIF1A | |
| SCHEMBL7271154 | 0.78 | KDM4E (0.65) | USP2PKMALOX15HIF1AHSD17B10 | |
| SCHEMBL5324072 | 0.78 | KDM4E (0.65) | USP2PKMALOX15HIF1AHSD17B10 | |
| SCHEMBL9122555 | 0.77 | PTPN1 (0.43) | KIF11USP2PKMALOX15HIF1A |
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-3203840-A1 | MODULATORS OF CYSTIC FIBROSIS TRANSMEMBRANE CONDUCTANCE REGULATOR | Vertex Pharmaceuticals Incorporated (US) | 2017-08-16 | — | — | EP | disclosed |
| WO-2016057572-A1 | MODULATORS OF CYSTIC FIBROSIS TRANSMEMBRANE CONDUCTANCE REGULATOR | MILLER MARK THOMAS (US) | 2016-04-14 | — | — | WO | disclosed |