Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.36 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.36 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.35 |
| ▸ | JAK2 | O60674 | 3/20 | 0.35 |
| ▸ | JAK1 | P23458 | 2/20 | 0.35 |
| ▸ | JAK3 | P52333 | 2/20 | 0.35 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.34 |
| ▸ | ITGA2B | P08514 | 1/20 | 0.34 |
| ▸ | F2R | P25116 | 1/20 | 0.34 |
| ▸ | WNT3 | P56703 | 1/20 | 0.34 |
| ▸ | SFRP1 | Q8N474 | 1/20 | 0.34 |
| ▸ | EPHX2 | P34913 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL12384401 | 1.00 | ALDH1A1 (0.41) | ALDH1A1LMNAMEN1POLBMAPT | |
| SCHEMBL24491596 | 0.92 | CYP2D6 (0.41) | ALDH1A1LMNAMEN1KMT2AKDM4E | |
| SCHEMBL24491611 | 0.83 | KDM4E (0.36) | ALDH1A1LMNAMEN1KMT2AKDM4E | |
| SCHEMBL13781662 | 0.82 | MEN1 (0.44) | ALDH1A1LMNAMEN1POLBMAPT | |
| SCHEMBL20464225 | 0.82 | ALDH1A1 (0.44) | ALDH1A1LMNAMEN1POLBMAPT | |
| SCHEMBL12384399 | 0.82 | CYP2D6 (0.47) | ALDH1A1LMNAMEN1KMT2AKDM4E | |
| SCHEMBL21430362 | 0.79 | ALDH1A1 (0.65) | ALDH1A1LMNAMEN1POLBMAPT | |
| SCHEMBL13781653 | 0.79 | GAA (0.45) | ALDH1A1MEN1MAPTKMT2ACYP2D6 | |
| SCHEMBL24627258 | 0.78 | ALDH1A1 (0.43) | ALDH1A1LMNAMEN1POLBMAPT | |
| SCHEMBL21430432 | 0.78 | JAK3 (0.42) | ALDH1A1LMNAMEN1POLBMAPT |
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 |
|---|---|---|---|---|---|---|---|
| EP-3858832-A1 | TRIFLUOROMETHYL-SUBSTITUTED SULFONAMIDE AS BCL-2-SELECTIVE INHIBITOR | Chia Tai Tianqing Pharmaceutical Group Co., Ltd. (CN) | 2021-08-04 | — | — | EP | disclosed |