Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.49 |
| ▸ | MEN1 | O00255 | 2/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.44 |
| ▸ | HPGD | P15428 | 3/20 | 0.41 |
| ▸ | CASP1 | P29466 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 3/20 | 0.37 |
| ▸ | PKM | P14618 | 2/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.36 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.36 |
| ▸ | PARP1 | P09874 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL11105312 | 1.00 | ALDH1A1 (0.49) | ALDH1A1MEN1KMT2AKDM4EHSD17B10 | |
| SCHEMBL11105319 | 1.00 | ALDH1A1 (0.49) | ALDH1A1MEN1KMT2AKDM4EHSD17B10 | |
| SCHEMBL9212615 | 0.76 | KDM4E (0.41) | ALDH1A1MEN1KMT2AKDM4EHSD17B10 | |
| SCHEMBL7319306 | 0.75 | KDM4E (0.39) | ALDH1A1MEN1KMT2AKDM4EHSD17B10 | |
| SCHEMBL9740875 | 0.75 | KDM4E (0.39) | ALDH1A1MEN1KMT2AKDM4EHSD17B10 | |
| SCHEMBL7319314 | 0.75 | KDM4E (0.39) | ALDH1A1MEN1KMT2AKDM4EHSD17B10 | |
| SCHEMBL30718533 | 0.74 | KDM4E (0.40) | ALDH1A1MEN1KMT2AKDM4EHSD17B10 | |
| SCHEMBL1529129 | 0.73 | CTDSP1 (0.36) | — | |
| SCHEMBL1529207 | 0.71 | GRM5 (0.44) | ALDH1A1KDM4EHSD17B10HPGDMAPT | |
| SCHEMBL10244712 | 0.71 | ADORA2B (0.37) | ALDH1A1MEN1KMT2AKDM4EHSD17B10 |
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-1765793-B1 | ANACETRAPIB AND OTHER CETP INHIBITPRS | MERCK SHARP & DOHME (US) | 2012-09-26 | — | — | EP | disclosed |
| EP-2415759-A1 | CETP inhibitors | Merck Sharp & Dohme Corporation (US) | 2012-02-08 | — | — | EP | disclosed |