Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 5/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.49 |
| ▸ | GAA | P10253 | 1/20 | 0.47 |
| ▸ | CNR2 | P34972 | 1/20 | 0.46 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.44 |
| ▸ | CA12 | O43570 | 1/20 | 0.43 |
| ▸ | CA1 | P00915 | 1/20 | 0.43 |
| ▸ | CA2 | P00918 | 1/20 | 0.43 |
| ▸ | CA9 | Q16790 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 4/20 | 0.42 |
| ▸ | LMNA | P02545 | 2/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | S1PR4 | O95977 | 1/20 | 0.42 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL10501798 | 0.84 | MEN1 (0.50) | MEN1KMT2AGAACNR2NR1H4 | |
| SCHEMBL28873320 | 0.83 | MEN1 (0.49) | MEN1KMT2AGAACNR2NR1H4 | |
| SCHEMBL4803624 | 0.82 | MEN1 (0.72) | MEN1KMT2AGAANR1H4MAPT | |
| SCHEMBL5747001 | 0.82 | MEN1 (0.72) | MEN1KMT2AGAANR1H4MAPT | |
| SCHEMBL9027170 | 0.80 | ALDH1A1 (0.65) | MEN1KMT2AMAPTLMNANPSR1 | |
| SCHEMBL28214526 | 0.80 | CNR2 (0.46) | MEN1KMT2AGAACNR2NR1H4 | |
| SCHEMBL9516698 | 0.79 | SMN1; SMN2 (0.44) | MEN1KMT2AGAAMAPTLMNA | |
| SCHEMBL28857962 | 0.79 | MEN1 (0.58) | MEN1KMT2AGAACNR2NR1H4 | |
| SCHEMBL14499484 | 0.79 | MEN1 (0.53) | MEN1KMT2AGAANR1H4MAPT | |
| SCHEMBL28754819 | 0.77 | CA12 (0.53) | MEN1KMT2ANR1H4CA12CA1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-110357789-B | N-substituted acrylamide derivative as DHODH inhibitor and preparation and application thereof | 华东理工大学 | 2022-09-30 | — | — | CN | disclosed |