Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALOX5 | P09917 | 3/20 | 0.42 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.42 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.42 |
| ▸ | KIF11 | P52732 | 1/20 | 0.41 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.40 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.39 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.39 |
| ▸ | CYP19A1 | P11511 | 3/20 | 0.39 |
| ▸ | P4HB | P07237 | 1/20 | 0.39 |
| ▸ | CNR1 | P21554 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | NAMPT | P43490 | 1/20 | 0.37 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL28949550 | 0.86 | GRIN1 (0.39) | ALOX5PTGS1PTGS2CYP19A1P4HB | |
| SCHEMBL28825672 | 0.85 | NFE2L2 (0.41) | P4HBNPC1TDP1NFE2L2 | |
| SCHEMBL28825623 | 0.82 | GRIN1 (0.40) | CYP11B2P4HBNPC1RAB9ANFE2L2 | |
| SCHEMBL28825460 | 0.78 | ALOX5 (0.46) | ALOX5PTGS1PTGS2CYP11B1CYP11B2 | |
| SCHEMBL28825515 | 0.76 | GRIN1 (0.38) | NFE2L2 | |
| SCHEMBL28825497 | 0.76 | GRIN1 (0.40) | NFE2L2 | |
| SCHEMBL13557773 | 0.75 | CYP19A1 (0.55) | KIF11CYP11B1CYP11B2CYP19A1TDP1 | |
| SCHEMBL8911420 | 0.75 | ALDH1A1 (0.62) | ALOX5PTGS1PTGS2CYP11B1CYP11B2 | |
| SCHEMBL8435518 | 0.75 | CYP1A1 (0.54) | CYP11B1CYP11B2ALDH1A1CYP19A1TDP1 | |
| SCHEMBL28825569 | 0.72 | NFE2L2 (0.46) | KIF11P4HBNPC1RAB9ANFE2L2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-114007610-A | Substituted heteroaromatic pyrazolopyridines and their use as modulators of the GLUN2B receptor | 詹森药业有限公司 | 2022-02-01 | — | — | CN | claimed |
| CN-114007610-A | Substituted heteroaromatic pyrazolopyridines and their use as modulators of the GLUN2B receptor | 詹森药业有限公司 | 2022-02-01 | — | — | CN | disclosed |