Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 1/20 | 0.40 |
| ▸ | CA1 | P00915 | 1/20 | 0.40 |
| ▸ | CA2 | P00918 | 1/20 | 0.40 |
| ▸ | CA9 | Q16790 | 1/20 | 0.40 |
| ▸ | NMT1 | P30419 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.38 |
| ▸ | MAOA | P21397 | 2/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | SLC40A1 | Q9NP59 | 1/20 | 0.35 |
| ▸ | GAK | O14976 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.35 |
| ▸ | RECQL | P46063 | 1/20 | 0.35 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.35 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 2/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL5681715 | 0.76 | PDE3B (0.37) | CA12CA1CA2CA9LMNA | |
| SCHEMBL24587386 | 0.76 | LMNA (0.35) | CA12CA1CA2CA9NMT1 | |
| SCHEMBL24588130 | 0.75 | CCR1 (0.38) | LMNACYP1A2CYP2C9CYP2C19ALDH1A1 | |
| SCHEMBL24587403 | 0.73 | CYP17A1 (0.35) | NMT1LMNANPSR1SMN1; SMN2CYP1A2 | |
| SCHEMBL31278202 | 0.73 | MAOA (0.42) | CA12CA1CA2CA9NMT1 | |
| SCHEMBL25044629 | 0.73 | CA2 (0.48) | CA12CA1CA2CA9LMNA | |
| SCHEMBL4080571 | 0.73 | MAOA (0.42) | CA12CA1CA2CA9NMT1 | |
| SCHEMBL31147147 | 0.71 | MAOA (0.41) | CA12CA1CA2CA9NMT1 | |
| SCHEMBL3979208 | 0.71 | MAOA (0.50) | CA12CA1CA2CA9SMN1; SMN2 | |
| Hydrochloric Acid SCHEMBL27652560 | 0.71 | MAOA (0.46) | CA12CA1CA2CA9NMT1 |
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-2022135430-A1 | HETEROARYL COMPOUNDS, PREPARATION METHODS AND USES THEREOF | InventisBio Co., Ltd. (CN) | 2022-06-30 | — | — | WO | disclosed |