Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRM5 | P41594 | 2/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.32 |
| ▸ | RAB9A | P51151 | 2/20 | 0.32 |
| ▸ | NPC1 | O15118 | 2/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.32 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
| ▸ | THRB | P10828 | 1/20 | 0.32 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.32 |
| ▸ | KDR | P35968 | 4/20 | 0.31 |
| ▸ | PDGFRB | P09619 | 3/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | FYN | P06241 | 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 | |
|---|---|---|---|---|
| SCHEMBL25588074 | 0.80 | CHRNA7 (0.38) | GRM5SMN1; SMN2RAB9ANPC1KDM4E | |
| SCHEMBL20049992 | 0.78 | CNR1 (0.39) | RAB9ANPC1CYP1A2CYP2C19L3MBTL1 | |
| SCHEMBL20049830 | 0.77 | EGLN1 (0.41) | MAP4K4 | |
| SCHEMBL25588429 | 0.76 | GRIN1 (0.35) | NPC1ALDH1A1FYNMAP4K4 | |
| SCHEMBL20049904 | 0.76 | GRIN2B (0.42) | RAB9ANPC1ALDH1A1ABL1 | |
| SCHEMBL20049886 | 0.75 | PSMB5 (0.42) | GRM5RAB9ANPC1KDM4EKDR | |
| SCHEMBL20049825 | 0.73 | GSK3B (0.42) | NPC1ALDH1A1MAPTMAP4K4 | |
| SCHEMBL20050027 | 0.73 | GRIN2B (0.44) | — | |
| SCHEMBL20049775 | 0.72 | NPC1 (0.42) | RAB9ANPC1KDRPDGFRBALDH1A1 | |
| SCHEMBL20049908 | 0.72 | CYP1A2 (0.40) | SMN1; SMN2RAB9ANPC1CYP1A2CYP2C19 |
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-2018067786-A1 | SUBSTITUTED 1H-IMIDAZO[4,5-B]PYRIDIN-2(3H)-ONES AND THEIR USE AS GLUN2B RECEPTOR MODULATORS | JANSSEN PHARMACEUTICA NV (BE) | 2018-04-12 | — | — | WO | disclosed |