Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM1A | O60341 | 1/20 | 0.38 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.38 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.38 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.38 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 5/20 | 0.36 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 4/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.35 |
| ▸ | IDO1 | P14902 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | QPCT | Q16769 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 5/20 | 0.34 |
| ▸ | NPC1 | O15118 | 4/20 | 0.34 |
| ▸ | TP53 | P04637 | 2/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | HTR2C | P28335 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL28202357 | 0.79 | ALDH1A1 (0.40) | MAPTRXFP1MEN1KMT2ACYP1A2 | |
| SCHEMBL825684 | 0.77 | CYP1A2 (0.38) | CYP1A2CYP2C19CYP2C9IDO1CYP3A4 | |
| SCHEMBL10569077 | 0.75 | SLC6A2 (0.46) | — | |
| SCHEMBL27527106 | 0.70 | NOTUM (0.58) | MAPTMEN1KMT2ATP53ALDH1A1 | |
| SCHEMBL28065822 | 0.67 | MAP4K4 (0.42) | CYP1A2RAB9ANPC1SMN1; SMN2ALDH1A1 | |
| SCHEMBL23918534 | 0.64 | KDM1A (0.52) | KDM1AADRA2AADRA2BADRA2CROCK1 | |
| Maleic Acid SCHEMBL10568944 | 0.64 | SLC6A2 (0.57) | MAPTMEN1KMT2ARAB9ASMN1; SMN2 | |
| SCHEMBL8570175 | 0.63 | ALDH1A1 (0.33) | TSHRALDH1A1 | |
| SCHEMBL83839 | 0.63 | ALDH1A1 (0.58) | MEN1KMT2ACYP1A2CYP2C19CYP2C9 | |
| SCHEMBL909073 | 0.62 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-3876933-A1 | NEUTROPHIL INFLAMMATION INHIBITOR AND USES THEREOF | Chang Gung University of Science and Technology (TW) | 2021-09-15 | — | — | EP | disclosed |