Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | NOS3 | P29474 | 1/20 | 0.33 |
| ▸ | NOS1 | P29475 | 1/20 | 0.33 |
| ▸ | NOS2 | P35228 | 1/20 | 0.33 |
| ▸ | PDXK | O00764 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL3802342 | 0.80 | HPGD (0.53) | ALDH1A1KMT2AKDM4EHPGDHSD17B10 | |
| SCHEMBL3798565 | 0.79 | ALDH1A1 (0.40) | ALDH1A1MAPK1KMT2AKDM4EHPGD | |
| SCHEMBL21279417 | 0.74 | CCR1 (0.38) | ALDH1A1KDM4EHPGDHSD17B10NOS3 | |
| SCHEMBL21657969 | 0.73 | ALDH1A1 (0.50) | ALDH1A1MAPK1KMT2AKDM4EHPGD | |
| SCHEMBL3252202 | 0.72 | NOS3 (0.41) | ALDH1A1KMT2AKDM4EHPGDHSD17B10 | |
| Hydrochloric Acid SCHEMBL11450712 | 0.72 | ALDH1A1 (0.48) | ALDH1A1MAPK1KMT2AKDM4EHPGD | |
| SCHEMBL3797317 | 0.71 | HSP90AB1 (0.45) | ALDH1A1MAPK1KMT2AKDM4EHPGD | |
| SCHEMBL22697046 | 0.69 | NOS3 (0.31) | NOS3NOS2 | |
| SCHEMBL11529645 | 0.68 | ALDH1A1 (0.58) | ALDH1A1MAPK1KMT2AKDM4EHPGD | |
| SCHEMBL31643772 | 0.68 | ALDH1A1 (0.58) | ALDH1A1MAPK1KMT2AKDM4EHPGD |
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-2010117425-A1 | CERTAIN SUBSTITUTED PYRIMIDINES, PHARMACEUTICAL COMPOSITIONS THEREOF, AND METHODS FOR THEIR USE | BIOGEN IDEC MA INC. (US) | 2010-10-14 | — | — | WO | disclosed |