Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.35 |
| ▸ | MAPT | P10636 | 3/20 | 0.35 |
| ▸ | HPGD | P15428 | 3/20 | 0.35 |
| ▸ | LMNA | P02545 | 2/20 | 0.35 |
| ▸ | NPC1 | O15118 | 2/20 | 0.35 |
| ▸ | RAB9A | P51151 | 2/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.32 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.32 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.32 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.32 |
| ▸ | PGR | P06401 | 2/20 | 0.32 |
| ▸ | MAOA | P21397 | 1/20 | 0.32 |
| ▸ | HTR2C | P28335 | 1/20 | 0.32 |
| ▸ | HTR2B | P41595 | 1/20 | 0.32 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.32 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.31 |
| ▸ | HTR1A | P08908 | 1/20 | 0.31 |
| ▸ | CHRM1 | P11229 | 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 | |
|---|---|---|---|---|
| SCHEMBL21433623 | 0.93 | ALDH1A1 (0.41) | ALDH1A1SMN1; SMN2KDM4EMAPTHPGD | |
| SCHEMBL19152920 | 0.88 | PGR (0.39) | ALDH1A1SMN1; SMN2KDM4EMAPTHPGD | |
| SCHEMBL26834607 | 0.86 | MAPT (0.32) | MAPTLMNANPC1RAB9APGR | |
| SCHEMBL25764535 | 0.79 | CYP1A2 (0.39) | ALDH1A1SMN1; SMN2KDM4EMAPTHPGD | |
| SCHEMBL30079660 | 0.74 | LPL (0.47) | ALDH1A1SMN1; SMN2KDM4EMAPTHPGD | |
| SCHEMBL29265 | 0.74 | LPL (0.47) | ALDH1A1SMN1; SMN2KDM4EMAPTHPGD | |
| SCHEMBL19003095 | 0.74 | CYP11B1 (0.30) | ALDH1A1SMN1; SMN2KDM4ELMNAHTT | |
| SCHEMBL24135395 | 0.72 | CASP1 (0.41) | CYP1A2PGRMAOAHSD17B10 | |
| SCHEMBL12056855 | 0.71 | LIPG (0.42) | PGR | |
| SCHEMBL21364239 | 0.70 | LPL (0.40) | — |
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-4212535-A1 | COMPOUND AND ORGANIC LIGHT-EMITTING ELEMENT COMPRISING SAME | Lg Chem, Ltd. (KR) | 2023-07-19 | — | — | EP | disclosed |