Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.62 |
| ▸ | NCF1 | P14598 | 5/20 | 0.58 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.49 |
| ▸ | HTT | P42858 | 2/20 | 0.49 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.49 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.49 |
| ▸ | MEN1 | O00255 | 1/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | USP2 | O75604 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.46 |
| ▸ | GALR3 | O60755 | 1/20 | 0.45 |
| ▸ | RAB9A | P51151 | 1/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.45 |
| ▸ | GPR3 | P46089 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL29955591 | 0.80 | MAOA (0.43) | CYP1A2NCF1L3MBTL1MEN1KMT2A | |
| SCHEMBL16010147 | 0.79 | NCF1 (0.45) | CYP1A2NCF1L3MBTL1HTTADRB2 | |
| SCHEMBL29955050 | 0.78 | ALDH1A1 (0.49) | CYP1A2NCF1MEN1KMT2AALDH1A1 | |
| SCHEMBL2652276 | 0.78 | ALDH1A1 (0.49) | CYP1A2NCF1MEN1KMT2AALDH1A1 | |
| SCHEMBL26695128 | 0.78 | BACE1 (0.61) | CYP1A2NCF1KDM4EALDH1A1HPGD | |
| SCHEMBL30199873 | 0.78 | CYP1A2 (0.64) | CYP1A2NCF1L3MBTL1HTTMEN1 | |
| SCHEMBL266459 | 0.78 | CYP1A2 (0.64) | CYP1A2NCF1L3MBTL1HTTMEN1 | |
| Water SCHEMBL29955616 | 0.77 | ALDH1A1 (0.47) | CYP1A2NCF1MEN1KMT2AALDH1A1 | |
| SCHEMBL29502790 | 0.77 | CYP1A2 (1.00) | CYP1A2NCF1L3MBTL1KMT2ACYP2C19 | |
| SCHEMBL89010 | 0.77 | CYP1A2 (1.00) | CYP1A2NCF1L3MBTL1KMT2ACYP2C19 |
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 |
|---|---|---|---|---|---|---|---|
| US-20220340893-A1 | BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES | NUEVOLUTION A/S (DK) | 2022-10-27 | — | — | US | disclosed |