Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRA2A | P08913 | 3/20 | 0.47 |
| ▸ | ADRA2B | P18089 | 3/20 | 0.47 |
| ▸ | ADRA2C | P18825 | 3/20 | 0.47 |
| ▸ | UGT2B7 | P16662 | 1/20 | 0.45 |
| ▸ | IKBKB | O14920 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | AOC3 | Q16853 | 2/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.37 |
| ▸ | ATM | Q13315 | 1/20 | 0.36 |
| ▸ | MMP9 | P14780 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | HTR2A | P28223 | 1/20 | 0.35 |
| ▸ | HTR2C | P28335 | 1/20 | 0.35 |
| ▸ | HTR2B | P41595 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL16746780 | 0.82 | KMT2A (0.41) | MEN1KMT2ACYP1A2ALDH1A1HTR2C | |
| SCHEMBL11642492 | 0.82 | KMT2A (0.41) | MEN1KMT2ACYP1A2ALDH1A1HTR2C | |
| SCHEMBL16746783 | 0.80 | JAK2 (0.41) | MEN1KMT2ACYP1A2ALDH1A1CYP3A4 | |
| SCHEMBL16746749 | 0.78 | JAK2 (0.39) | MEN1KMT2ACYP1A2ALDH1A1 | |
| SCHEMBL16746779 | 0.77 | PTGS1 (0.47) | MEN1KMT2ACYP1A2CYP2D6ALDH1A1 | |
| SCHEMBL16746781 | 0.77 | CYP3A4 (0.41) | AOC3CYP1A2CYP2D6ALDH1A1CYP3A4 | |
| SCHEMBL16746820 | 0.76 | DAO (0.40) | ALDH1A1HTR2C | |
| SCHEMBL16746862 | 0.76 | ADRB2 (0.41) | ADRA2AADRA2BADRA2CIKBKBMEN1 | |
| SCHEMBL16746857 | 0.76 | IKBKB (0.39) | IKBKBTSHRALDH1A1HSD17B10 | |
| SCHEMBL16746775 | 0.76 | DHFR (0.40) | AOC3ALDH1A1 |
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-2015076353-A1 | 3-ALKYLPYRAZOLOPYRIDINE DERIVATIVE | 第一三共株式会社 | 2015-05-28 | — | — | WO | disclosed |