Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRM5 | P41594 | 1/20 | 0.37 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.37 |
| ▸ | DHODH | Q02127 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.35 |
| ▸ | CDC25B | P30305 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | F2 | P00734 | 2/20 | 0.35 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.35 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | RECQL | P46063 | 1/20 | 0.35 |
| ▸ | PARP15 | Q460N3 | 1/20 | 0.35 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL29151462 | 1.00 | GRM5 (0.37) | GRM5AKR1B1DHODHMEN1KMT2A | |
| SCHEMBL2806149 | 0.84 | MEN1 (0.37) | AKR1B1MEN1KMT2ATDP1MTNR1A | |
| SCHEMBL8965862 | 0.83 | AKR1B1 (0.50) | AKR1B1MEN1KMT2ATDP1CDC25B | |
| SCHEMBL23043017 | 0.82 | NQO2 (0.52) | GRM5AKR1B1TDP1CDC25BKDM4E | |
| SCHEMBL30391379 | 0.82 | NQO2 (0.52) | GRM5AKR1B1TDP1CDC25BKDM4E | |
| SCHEMBL30182306 | 0.81 | GRM5 (0.37) | GRM5CDC25BCYP1A2CYP2A6NQO1 | |
| SCHEMBL25991555 | 0.81 | GRM5 (0.37) | GRM5CDC25BCYP1A2CYP2A6NQO1 | |
| SCHEMBL19637220 | 0.80 | CYP1A2 (0.48) | GRM5CDC25BL3MBTL1ALDH1A1LMNA | |
| SCHEMBL19616662 | 0.79 | CYP1A2 (0.36) | GRM5TDP1CDC25BL3MBTL1KDM4E | |
| SCHEMBL19616584 | 0.79 | CYP1A2 (0.40) | GRM5MEN1KMT2ATDP1CDC25B |
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-117466917-A | Heterocyclic derivative, preparation method and medical application thereof | 浙江海正药业股份有限公司 | 2024-01-30 | — | — | CN | disclosed |