Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.43 |
| ▸ | RECQL | P46063 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL17028819 | 0.93 | ALDH1A1 (0.46) | NPC1MEN1KMT2AKDM4EALDH1A1 | |
| SCHEMBL17028826 | 0.86 | FAAH (0.46) | MEN1KMT2AKDM4EALDH1A1LMNA | |
| SCHEMBL17028817 | 0.85 | MGLL (0.41) | MEN1KMT2AKDM4EALDH1A1GAA | |
| SCHEMBL17028818 | 0.83 | ALDH1A1 (0.46) | MEN1KMT2AKDM4EALDH1A1LMNA | |
| SCHEMBL17028825 | 0.83 | ALDH1A1 (0.43) | KDM4EALDH1A1LMNACYP2D6MTNR1B | |
| SCHEMBL17028837 | 0.81 | ALDH1A1 (0.43) | MEN1KMT2AKDM4EALDH1A1LMNA | |
| SCHEMBL17028816 | 0.80 | ALDH1A1 (0.49) | KDM4EALDH1A1LMNAMTNR1BTDP1 | |
| SCHEMBL17028828 | 0.80 | ALDH1A1 (0.48) | MEN1KMT2AKDM4EALDH1A1LMNA | |
| SCHEMBL17028835 | 0.80 | ALDH1A1 (0.43) | MEN1KMT2AKDM4EALDH1A1LMNA | |
| SCHEMBL17028840 | 0.80 | L3MBTL1 (0.40) | MEN1KMT2AKDM4EALDH1A1LMNA |
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-3107542-A1 | PROCESS FOR PREPARING N-BENZYL-3-HYDROXY-4-SUBSTITUTED-PYRIDIN-2-(1H)-ONES | Aerpio Therapeutics, Inc. (US) | 2016-12-28 | — | — | EP | disclosed |
| WO-2015126860-A1 | PROCESS FOR PREPARING N-BENZYL-3-HYDROXY-4-SUBSTITUTED-PYRIDIN-2-(1H)-ONES | AERPIO THERAPEUTICS, INC. (US) | 2015-08-27 | — | — | WO | disclosed |