Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MCL1 | Q07820 | 6/20 | 0.43 |
| ▸ | HTR1A | P08908 | 5/20 | 0.40 |
| ▸ | DRD4 | P21917 | 5/20 | 0.40 |
| ▸ | HTR1B | P28222 | 5/20 | 0.40 |
| ▸ | DRD3 | P35462 | 4/20 | 0.40 |
| ▸ | DRD2 | P14416 | 2/20 | 0.38 |
| ▸ | HTR2A | P28223 | 1/20 | 0.38 |
| ▸ | HTR2C | P28335 | 1/20 | 0.37 |
| ▸ | BRD4 | O60885 | 1/20 | 0.33 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.33 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.32 |
| ▸ | PRKAB2 | O43741 | 1/20 | 0.31 |
| ▸ | PRKAG1 | P54619 | 1/20 | 0.31 |
| ▸ | PRKAA2 | P54646 | 1/20 | 0.31 |
| ▸ | PRKAA1 | Q13131 | 1/20 | 0.31 |
| ▸ | PRKAG3 | Q9UGI9 | 1/20 | 0.31 |
| ▸ | PRKAG2 | Q9UGJ0 | 1/20 | 0.31 |
| ▸ | PRKAB1 | Q9Y478 | 1/20 | 0.31 |
| ▸ | PIM1 | P11309 | 1/20 | 0.31 |
| ▸ | PIK3CD | O00329 | 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 | |
|---|---|---|---|---|
| SCHEMBL20605117 | 1.00 | MCL1 (0.43) | MCL1HTR1ADRD4HTR1BDRD3 | |
| SCHEMBL23809281 | 0.87 | MCL1 (0.42) | MCL1HTR1ADRD4HTR1BDRD3 | |
| SCHEMBL20604964 | 0.87 | HTR1A (0.46) | MCL1HTR1ADRD4HTR1BDRD3 | |
| SCHEMBL20604925 | 0.86 | HTR1A (0.42) | MCL1HTR1ADRD4HTR1BDRD3 | |
| SCHEMBL30790895 | 0.86 | HTR1A (0.42) | MCL1HTR1ADRD4HTR1BDRD3 | |
| SCHEMBL20604923 | 0.84 | HTR1A (0.44) | MCL1HTR1ADRD4HTR1BDRD3 | |
| SCHEMBL20604926 | 0.79 | DRD2 (0.39) | HTR1ADRD4HTR1BDRD3DRD2 | |
| SCHEMBL20604874 | 0.79 | DRD2 (0.41) | HTR1ADRD4HTR1BDRD3DRD2 | |
| SCHEMBL20604886 | 0.77 | DRD2 (0.38) | MCL1HTR1ADRD4HTR1BDRD3 | |
| SCHEMBL20604943 | 0.75 | GRIN2B (0.43) | MCL1 |
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-4292662-A2 | SUBSTITUTED INDOLE MCL-1 INHIBITORS | Vanderbilt University (US) | 2023-12-20 | — | — | EP | disclosed |