Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BACE1 | P56817 | 1/20 | 0.44 |
| ▸ | ACHE | P22303 | 1/20 | 0.40 |
| ▸ | RAD52 | P43351 | 1/20 | 0.39 |
| ▸ | BRD4 | O60885 | 1/20 | 0.39 |
| ▸ | CYP2A13 | Q16696 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | HTR2C | P28335 | 2/20 | 0.36 |
| ▸ | HTR2B | P41595 | 2/20 | 0.36 |
| ▸ | DRD1 | P21728 | 1/20 | 0.35 |
| ▸ | DRD5 | P21918 | 1/20 | 0.35 |
| ▸ | KDM1A | O60341 | 1/20 | 0.35 |
| ▸ | HTR1A | P08908 | 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 | |
|---|---|---|---|---|
| SCHEMBL24005859 | 0.81 | ACHE (0.40) | ACHEHTR1ASLC6A4 | |
| SCHEMBL13162086 | 0.81 | MAOB (0.42) | ACHECYP2A13 | |
| SCHEMBL25613520 | 0.80 | BACE1 (0.41) | BACE1ACHEBRD4CYP2A13ALDH1A1 | |
| SCHEMBL24005468 | 0.78 | ACHE (0.38) | ACHEHTR1A | |
| SCHEMBL4296695 | 0.78 | DRD2 (0.43) | ALDH1A1CYP2D6MAPK1KDM4EHTR2C | |
| SCHEMBL16130557 | 0.76 | CHRNB2 (0.55) | BACE1LMNAHTR1A | |
| SCHEMBL16130585 | 0.76 | CHRNB2 (0.55) | BACE1LMNAHTR1A | |
| SCHEMBL2606087 | 0.76 | CHRNB2 (0.55) | BACE1LMNAHTR1A | |
| SCHEMBL27224210 | 0.76 | BACE1 (0.57) | BACE1CYP2A13ALDH1A1LMNASMN1; SMN2 | |
| SCHEMBL27224160 | 0.76 | BACE1 (0.57) | BACE1CYP2A13ALDH1A1LMNASMN1; SMN2 |
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-2021223736-A1 | COMPOUNDS AS BCL-2 INHIBITORS | FOCHON PHARMACEUTICALS, LTD. (CN) | 2021-11-11 | — | — | WO | disclosed |