Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | THRB | P10828 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.34 |
| ▸ | LMNA | P02545 | 2/20 | 0.34 |
| ▸ | GAA | P10253 | 2/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | CA1 | P00915 | 1/20 | 0.33 |
| ▸ | PTPN5 | P54829 | 1/20 | 0.32 |
| ▸ | CYP2A6 | P11509 | 3/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.32 |
| ▸ | NOS3 | P29474 | 1/20 | 0.31 |
| ▸ | NOS1 | P29475 | 1/20 | 0.31 |
| ▸ | NOS2 | P35228 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL157640 | 0.78 | SMN1; SMN2 (0.42) | SMN1; SMN2KDM4EHSD17B10MAPTCYP2A6 | |
| SCHEMBL806483 | 0.75 | PDPK1 (0.39) | LMNAGAAMAPTCYP2A6CYP1A2 | |
| SCHEMBL22607042 | 0.75 | SELL (0.41) | TDP1SMN1; SMN2ALOX15CYP3A4TP53 | |
| SCHEMBL18875994 | 0.75 | CYP1A2 (0.32) | CYP2A6CYP1A2 | |
| SCHEMBL12135667 | 0.75 | CYP1A2 (0.32) | MAPTCYP2A6CYP1A2 | |
| SCHEMBL20999918 | 0.75 | ALDH1A1 (0.40) | SMN1; SMN2ALDH1A1GAA | |
| SCHEMBL15018567 | 0.72 | ACHE (0.43) | SMN1; SMN2CYP3A4ALDH1A1MAPTTSHR | |
| SCHEMBL15910715 | 0.71 | ALDH1A1 (0.38) | SMN1; SMN2ALOX15CYP3A4THRBALDH1A1 | |
| SCHEMBL21118241 | 0.71 | MAPT (0.40) | TDP1SMN1; SMN2ALOX15CYP3A4THRB | |
| SCHEMBL18876008 | 0.71 | KDM4E (0.33) | TDP1SMN1; SMN2ALOX15TP53ALDH1A1 |
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 |