Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 3/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | TP53 | P04637 | 2/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | MLNR | O43193 | 1/20 | 0.41 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.41 |
| ▸ | EGFR | P00533 | 1/20 | 0.41 |
| ▸ | FYN | P06241 | 1/20 | 0.41 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.41 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.41 |
| ▸ | HTR1A | P08908 | 1/20 | 0.41 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.41 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.41 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.41 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.41 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL27554819 | 0.98 | KMT2A (0.39) | KMT2ACYP2D6MEN1LMNATP53 | |
| Hydrochloric Acid SCHEMBL27915257 | 0.96 | KMT2A (0.41) | KMT2ACYP2D6MEN1LMNATP53 | |
| SCHEMBL27750679 | 0.93 | KMT2A (0.33) | KMT2ACYP2D6MEN1LMNATP53 | |
| Oxalic Acid SCHEMBL28208898 | 0.90 | KMT2A (0.42) | KMT2ACYP2D6MEN1LMNATP53 | |
| SCHEMBL5258302 | 0.85 | HRH3 (0.38) | KMT2ACYP2D6MEN1LMNATP53 | |
| SCHEMBL28101864 | 0.83 | — | — | |
| SCHEMBL28254273 | 0.81 | CYP2D6 (0.43) | KMT2ACYP2D6MEN1LMNATP53 | |
| SCHEMBL27922794 | 0.81 | HRH3 (0.34) | KMT2AFDPSHRH3 | |
| SCHEMBL23418534 | 0.79 | LTA4H (0.41) | KMT2ACYP2D6MEN1LMNATP53 | |
| SCHEMBL21267964 | 0.79 | LTA4H (0.41) | KMT2ACYP2D6MEN1LMNATP53 |
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 |
|---|---|---|---|---|---|---|---|
| CN-104995191-A | Tricyclic quinoline and quinoxaline derivatives | ABBVIE DEUTSCHLAND | 2015-10-21 | — | — | CN | disclosed |