Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP4F2 | P78329 | 1/20 | 0.37 |
| ▸ | CYP4A11 | Q02928 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.34 |
| ▸ | SLC1A2 | P43004 | 1/20 | 0.32 |
| ▸ | SLC1A1 | P43005 | 1/20 | 0.32 |
| ▸ | GRM2 | Q14416 | 2/20 | 0.31 |
| ▸ | GRM3 | Q14832 | 2/20 | 0.31 |
| ▸ | GRM4 | Q14833 | 2/20 | 0.31 |
| ▸ | LMNA | P02545 | 2/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.31 |
| ▸ | GRM8 | O00222 | 1/20 | 0.31 |
| ▸ | GRM6 | O15303 | 1/20 | 0.31 |
| ▸ | GRM5 | P41594 | 1/20 | 0.31 |
| ▸ | MTOR | P42345 | 1/20 | 0.31 |
| ▸ | GRM1 | Q13255 | 1/20 | 0.31 |
| ▸ | PLCB1 | Q9NQ66 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL10595241 | 0.85 | GRM2 (0.32) | SLC1A2SLC1A1GRM2GRM3GRM4 | |
| SCHEMBL988351 | 0.82 | GRM4 (0.38) | SLC1A2SLC1A1GRM2GRM3GRM4 | |
| Hydrochloric Acid SCHEMBL25405452 | 0.81 | GRM4 (0.36) | SLC1A2SLC1A1GRM2GRM3GRM4 | |
| Hydrochloric Acid SCHEMBL28445038 | 0.81 | GRM4 (0.36) | SLC1A2SLC1A1GRM2GRM3GRM4 | |
| Hydrochloric Acid SCHEMBL628181 | 0.81 | GRM4 (0.36) | SLC1A2SLC1A1GRM2GRM3GRM4 | |
| Hydrochloric Acid SCHEMBL3267782 | 0.81 | GRM4 (0.36) | SLC1A2SLC1A1GRM2GRM3GRM4 | |
| SCHEMBL1247340 | 0.80 | CYP2C19 (0.34) | GRM2GRM3GRM4LMNACYP1A2 | |
| SCHEMBL29184375 | 0.80 | NPSR1 (0.40) | CYP4F2CYP4A11NPSR1MAPTCYP1A2 | |
| SCHEMBL38190 | 0.77 | CYP2C19 (0.40) | SLC1A2SLC1A1GRM2GRM3GRM4 | |
| SCHEMBL28877895 | 0.76 | MAPT (0.31) | MAPTLMNAPOLB |
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-113149996-B | Polycyclic amide derivative as CDK9 inhibitor, and preparation method and application thereof | 苏州阿尔脉生物科技有限公司 | 2022-12-20 | — | — | CN | disclosed |