Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NFATC1 | O95644 | 1/20 | 0.33 |
| ▸ | GSK3B | P49841 | 1/20 | 0.33 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 2/20 | 0.31 |
| ▸ | TSHR | P16473 | 2/20 | 0.31 |
| ▸ | FAAH | O00519 | 1/20 | 0.31 |
| ▸ | CA1 | P00915 | 1/20 | 0.31 |
| ▸ | CA2 | P00918 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.31 |
| ▸ | HPGD | P15428 | 1/20 | 0.31 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.31 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.31 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.31 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.31 |
| ▸ | HTR2C | P28335 | 1/20 | 0.31 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.31 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.31 |
| ▸ | GABRA3 | P34903 | 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 | |
|---|---|---|---|---|
| SCHEMBL24528143 | 0.73 | KIF11 (0.33) | CA2 | |
| SCHEMBL24528149 | 0.71 | GABRP (0.32) | GABRA1GABRB1GABRG2GABRB3GABRA5 | |
| SCHEMBL24527753 | 0.70 | TNF (0.40) | NFATC1GSK3BDYRK1ACYP1A2HPGD | |
| SCHEMBL24528173 | 0.69 | DYRK1A (0.39) | NFATC1GSK3BDYRK1ALMNA | |
| SCHEMBL24523735 | 0.69 | BRD1 (0.31) | — | |
| SCHEMBL24527756 | 0.68 | TNF (0.38) | GSK3BDYRK1ACYP1A2 | |
| SCHEMBL13051657 | 0.67 | GABRA1 (0.41) | LMNATSHRFAAHCA1CA2 | |
| SCHEMBL24528536 | 0.67 | MAOA (0.40) | NFATC1GSK3BDYRK1ALMNACYP1A2 | |
| SCHEMBL24528090 | 0.67 | TNF (0.41) | GSK3BDYRK1ACYP1A2 | |
| SCHEMBL27010716 | 0.66 | GABRA1 (0.40) | LMNATSHRFAAHCA1CA2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2022129113-A1 | NITROGENOUS HETEROAROMATIC COMPOUNDS FOR ORGANIC ELECTROLUMINESCENT DEVICES | MERCK PATENT GMBH (DE) | 2022-06-23 | — | — | WO | disclosed |