Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | BACE1 | P56817 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 2/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | XBP1 | P17861 | 1/20 | 0.36 |
| ▸ | CNR2 | P34972 | 1/20 | 0.35 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.34 |
| ▸ | KMO | O15229 | 1/20 | 0.34 |
| ▸ | PSMB5 | P28074 | 1/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.33 |
| ▸ | KDM4B | O94953 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL5195798 | 0.89 | ALDH1A1 (0.48) | TDP1ALDH1A1TP53CYP3A4TSHR | |
| SCHEMBL5192647 | 0.89 | ALDH1A1 (0.48) | TDP1ALDH1A1TP53CYP3A4TSHR | |
| SCHEMBL21307873 | 0.87 | BACE1 (0.35) | TDP1ALDH1A1TP53CYP3A4TSHR | |
| SCHEMBL31089055 | 0.84 | CNR2 (0.41) | TDP1ALDH1A1TP53CYP3A4TSHR | |
| SCHEMBL10789838 | 0.80 | CNR2 (0.39) | TDP1ALDH1A1TP53BACE1HTT | |
| SCHEMBL27943033 | 0.79 | HTR2C (0.55) | TDP1ALDH1A1TP53CYP3A4TSHR | |
| SCHEMBL7114890 | 0.78 | ACHE (0.44) | TDP1HTTSMN1; SMN2MAPTCNR2 | |
| SCHEMBL10492691 | 0.78 | BACE1 (0.40) | ALDH1A1TP53BACE1HTTSMN1; SMN2 | |
| SCHEMBL5178585 | 0.78 | ACHE (0.44) | TDP1HTTSMN1; SMN2MAPTCNR2 | |
| SCHEMBL10883627 | 0.78 | ACHE (0.44) | TDP1HTTSMN1; SMN2MAPTCNR2 |
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-4016656-A1 | ORGANOMETALLIC COMPOUND, ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME, AND DIAGNOSTIC COMPOSITION INCLUDING THE ORGANOMETALLIC COMPOUND | Samsung Electronics Co., Ltd. (KR) | 2022-06-22 | — | — | EP | disclosed |