Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.50 |
| ▸ | MAPT | P10636 | 4/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.46 |
| ▸ | ERN1 | O75460 | 1/20 | 0.42 |
| ▸ | TRIM24 | O15164 | 1/20 | 0.41 |
| ▸ | TRIM33 | Q9UPN9 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 4/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.40 |
| ▸ | HSP90AA1 | P07900 | 3/20 | 0.40 |
| ▸ | HSP90AB1 | P08238 | 2/20 | 0.40 |
| ▸ | HTT | P42858 | 2/20 | 0.40 |
| ▸ | ATM | Q13315 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | BLM | P54132 | 1/20 | 0.40 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | CASP1 | P29466 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 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 | |
|---|---|---|---|---|
| Quinoxaline SCHEMBL1335895 | 0.90 | ALDH1A1 (0.44) | ALDH1A1MAPTKDM4EERN1MEN1 | |
| Biphenyl SCHEMBL29090175 | 0.89 | ALDH1A1 (0.46) | ALDH1A1MAPTKDM4EERN1MEN1 | |
| Quinoline SCHEMBL1337002 | 0.86 | ALDH1A1 (0.74) | ALDH1A1MAPTKDM4EMEN1KMT2A | |
| Formic Acid SCHEMBL27894493 | 0.84 | ALDH1A1 (0.50) | ALDH1A1MAPTKDM4EERN1TRIM24 | |
| SCHEMBL8194 | 0.83 | ALDH1A1 (0.67) | ALDH1A1MAPTKDM4EMEN1KMT2A | |
| SCHEMBL30099834 | 0.83 | ALDH1A1 (0.67) | ALDH1A1MAPTKDM4EMEN1KMT2A | |
| Formaldehyde SCHEMBL27344975 | 0.80 | ALDH1A1 (0.57) | ALDH1A1MAPTKDM4EMEN1KMT2A | |
| SCHEMBL29095245 | 0.80 | ALDH1A1 (0.63) | ALDH1A1MAPTKDM4EMEN1KMT2A | |
| Water SCHEMBL28824188 | 0.80 | ALDH1A1 (0.63) | ALDH1A1MAPTKDM4EMEN1KMT2A | |
| SCHEMBL29592061 | 0.80 | ALDH1A1 (0.63) | ALDH1A1MAPTKDM4EMEN1KMT2A |
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 9 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-104812756-A | Multiple kinase pathway inhibitors | MANNKIND CORP | 2015-07-29 | — | — | CN | disclosed |
| CN-101821266-B | Modulators of cystic fibrosis transmembrane channel regulators | VERTEX PHARMA | 2014-03-12 | — | — | CN | disclosed |
| CN-1964975-B | Hiv integrase inhibitors | MERCK SHARP & DOHME CORP. (US) | 2011-11-30 | — | — | CN | disclosed |
| CN-101821266-A | Modulators of cystic fibrosis transmembrane channel regulators | VERTEX PHARMA | 2010-09-01 | — | — | CN | disclosed |
| CN-1964975-A | HIV integrase inhibitors | MERCK & CO INC (US) | 2007-05-16 | — | — | CN | disclosed |
| CN-1416430-A | 4-oxo-1,4-dihydro[1,8]naphthyridine-3-carboxamides as antiviral agents | PHARMACIA & UPJOHM CO (US) | 2003-05-07 | — | — | CN | disclosed |
| CN-1069643-C | Naphthyridine derivatives and their analogues inhibiting cytomegalovirus | IAF BIOCHEM INT (CA) | 2001-08-15 | — | — | CN | disclosed |
| CN-1268136-A | Substituted 4-oxo-naphthyridine-3-carboxamides as gamma-aminobutyric acid brain receptor ligands | NEUROGEN CORP (US) | 2000-09-27 | — | — | CN | disclosed |
| CN-1218473-A | Naphthyridine derivatives and their analogues inhibiting cytomegalovirus | IAF BIOCHEM INT (CA) | 1999-06-02 | — | — | CN | disclosed |