Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 3/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.39 |
| ▸ | HTR1A | P08908 | 2/20 | 0.39 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.39 |
| ▸ | HTR2A | P28223 | 2/20 | 0.39 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.39 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.39 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | MLNR | O43193 | 1/20 | 0.39 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.39 |
| ▸ | EGFR | P00533 | 1/20 | 0.39 |
| ▸ | FYN | P06241 | 1/20 | 0.39 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL11989575 | 0.88 | CYP2D6 (0.41) | HRH3CYP2D6KMT2ACYP1A2HTR1A | |
| SCHEMBL172275 | 0.82 | PLG (0.40) | HRH3CYP2D6KMT2ACYP1A2HTR1A | |
| SCHEMBL6050340 | 0.78 | CYP1A2 (0.46) | HRH3CYP2D6KMT2ACYP1A2HTR1A | |
| SCHEMBL31022868 | 0.78 | CYP1A2 (0.46) | HRH3CYP2D6KMT2ACYP1A2HTR1A | |
| SCHEMBL3224559 | 0.78 | CYP1A2 (0.46) | HRH3CYP2D6KMT2ACYP1A2HTR1A | |
| SCHEMBL10330201 | 0.77 | HRH3 (0.40) | HRH3CYP2D6KMT2ACYP1A2HTR1A | |
| SCHEMBL293993 | 0.76 | HRH3 (0.45) | HRH3CYP2D6KMT2ACYP1A2HTR1A | |
| SCHEMBL20861209 | 0.76 | CYP1A2 (0.50) | HRH3CYP2D6KMT2ACYP1A2HTR1A | |
| SCHEMBL24854641 | 0.76 | CYP1A2 (0.50) | HRH3CYP2D6KMT2ACYP1A2HTR1A | |
| SCHEMBL11216082 | 0.76 | SIGMAR1 (0.46) | HRH3CYP2D6KMT2ACYP1A2HTR1A |
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-3825320-A1 | ORGANOMETALLIC COMPOUND, ORGANIC LIGHT-EMITTING DEVICE INCLUDING ORGANOMETALLIC COMPOUND, AND DIAGNOSTIC COMPOSITION INCLUDING ORGANOMETALLIC COMPOUND | Samsung Electronics Co., Ltd. (KR) | 2021-05-26 | — | — | EP | disclosed |