Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.41 |
| ▸ | PRKDC | P78527 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 2/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | GALR3 | O60755 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | GPR35 | Q9HC97 | 1/20 | 0.34 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.32 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.32 |
| ▸ | HPGD | P15428 | 2/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL22754449 | 0.86 | ALDH1A1 (0.35) | ALDH1A1MAPTKDM4ECYP3A4ALOX15 | |
| SCHEMBL21729366 | 0.81 | ALDH1A1 (0.51) | ALDH1A1MAPTKDM4ECYP3A4ALOX15 | |
| SCHEMBL20147110 | 0.81 | POLB (0.35) | ALDH1A1MAPTKDM4ECYP3A4ALOX15 | |
| SCHEMBL29551672 | 0.76 | ALDH1A1 (0.40) | ALDH1A1MAPTKDM4ECYP3A4ALOX15 | |
| SCHEMBL25874795 | 0.76 | ALDH1A1 (0.40) | ALDH1A1MAPTTDP1TSHRHTT | |
| SCHEMBL18622104 | 0.76 | ALDH1A1 (0.54) | ALDH1A1MAPTKDM4ECYP3A4ALOX15 | |
| SCHEMBL395255 | 0.75 | ALDH1A1 (0.45) | ALDH1A1MAPTKDM4ECYP3A4ALOX15 | |
| SCHEMBL395029 | 0.74 | ALDH1A1 (0.41) | ALDH1A1MAPTKDM4ECYP3A4ALOX15 | |
| SCHEMBL29551353 | 0.74 | ALDH1A1 (0.41) | ALDH1A1MAPTKDM4ECYP3A4ALOX15 | |
| SCHEMBL397099 | 0.73 | LMNA (0.47) | ALDH1A1MAPTKDM4ECYP3A4ALOX15 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3330255-A1 | PROCESS FOR MAKING MODULATORS OF CYSTIC FIBROSIS TRANSMEMBRANE CONDUCTANCE REGULATOR | Vertex Pharmaceuticals Incorporated (US) | 2018-06-06 | — | — | EP | disclosed |