Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOA | P21397 | 4/20 | 0.40 |
| ▸ | CES1 | P23141 | 2/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | BCHE | P06276 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | METAP1 | P53582 | 1/20 | 0.33 |
| ▸ | MAOB | P27338 | 3/20 | 0.32 |
| ▸ | MIF | P14174 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 2/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | S100A4 | P26447 | 1/20 | 0.31 |
| ▸ | HTR6 | P50406 | 1/20 | 0.30 |
| ▸ | CDC25B | P30305 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL17359924 | 0.84 | MEN1 (0.34) | MAOACES1L3MBTL1BCHEALDH1A1 | |
| SCHEMBL17751063 | 0.78 | PTPRC (0.42) | TDP1L3MBTL1CYP1A2METAP1S100A4 | |
| SCHEMBL6552234 | 0.73 | CES1 (0.56) | MAOACES1TDP1L3MBTL1BCHE | |
| SCHEMBL9321655 | 0.66 | MAOA (0.50) | MAOACES1TDP1L3MBTL1BCHE | |
| SCHEMBL2566227 | 0.66 | CES1 (0.50) | MAOACES1BCHEALDH1A1CYP1A2 | |
| SCHEMBL14054414 | 0.66 | MAOA (0.50) | MAOACES1TDP1L3MBTL1BCHE | |
| SCHEMBL396140 | 0.66 | MAOA (0.50) | MAOACES1TDP1L3MBTL1BCHE | |
| SCHEMBL7960264 | 0.66 | HTR6 (0.41) | MAOACES1TDP1L3MBTL1BCHE | |
| SCHEMBL9364591 | 0.65 | MEN1 (0.61) | MAOACES1TDP1BCHEALDH1A1 | |
| SCHEMBL10590259 | 0.65 | MAOA (0.48) | MAOACES1TDP1L3MBTL1BCHE |
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-3033405-B1 | MATERIALS FOR ELECTRONIC DEVICES | MERCK PATENT GMBH (DE) | 2018-05-09 | — | — | EP | disclosed |