Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP11B1 | P15538 | 4/20 | 0.37 |
| ▸ | CYP11B2 | P19099 | 4/20 | 0.37 |
| ▸ | GPR55 | Q9Y2T6 | 1/20 | 0.32 |
| ▸ | KIF11 | P52732 | 1/20 | 0.31 |
| ▸ | IDH1 | O75874 | 1/20 | 0.31 |
| ▸ | DAO | P14920 | 1/20 | 0.31 |
| ▸ | CYP19A1 | P11511 | 4/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.30 |
| ▸ | METAP2 | P50579 | 1/20 | 0.30 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.30 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.30 |
| ▸ | SLC22A6 | Q4U2R8 | 1/20 | 0.30 |
| ▸ | SLC22A8 | Q8TCC7 | 1/20 | 0.30 |
| ▸ | SLC22A12 | Q96S37 | 1/20 | 0.30 |
| ▸ | SLC22A11 | Q9NSA0 | 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 | |
|---|---|---|---|---|
| SCHEMBL10690255 | 0.79 | CYP11B1 (0.44) | CYP11B1CYP11B2GPR55KIF11IDH1 | |
| SCHEMBL31305866 | 0.74 | — | — | |
| SCHEMBL3749196 | 0.73 | CYP11B1 (0.43) | CYP11B1CYP11B2KIF11DAOCYP19A1 | |
| SCHEMBL30803919 | 0.72 | DAO (0.37) | CYP11B1CYP11B2DAO | |
| Piperazine SCHEMBL28793735 | 0.69 | CHRNB2 (0.38) | CYP11B1CYP11B2IDH1DAOALDH1A1 | |
| SCHEMBL30164989 | 0.69 | KIF11 (0.37) | CYP11B1CYP11B2KIF11CYP19A1ALDH1A1 | |
| SCHEMBL29791400 | 0.68 | CYP19A1 (0.44) | KIF11CYP19A1CYP1A2METAP2CYP3A4 | |
| SCHEMBL21744244 | 0.67 | CYP11B2 (0.56) | CYP11B1CYP11B2GPR55KIF11IDH1 | |
| SCHEMBL9693899 | 0.65 | CES2 (0.42) | ALDH1A1CYP3A4 | |
| SCHEMBL4461544 | 0.65 | CES2 (0.48) | ALDH1A1CYP3A4 |
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-2023006013-A1 | NOVEL PARP7 INHIBITOR AND USE THEREOF | 上海齐鲁制药研究中心有限公司 | 2023-02-02 | — | — | WO | disclosed |