Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PYGM | P11217 | 12/20 | 0.53 |
| ▸ | HTR2A | P28223 | 4/20 | 0.47 |
| ▸ | HTR2C | P28335 | 2/20 | 0.47 |
| ▸ | SRC | P12931 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | DRD3 | P35462 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL23867511 | 0.90 | PYGM (0.53) | PYGMHPGD | |
| SCHEMBL23867525 | 0.85 | HTR2A (0.49) | HTR2AHTR2CSRCHPGDDRD3 | |
| SCHEMBL23867575 | 0.83 | PYGM (0.51) | PYGMHPGD | |
| SCHEMBL23867573 | 0.80 | PYGM (0.51) | PYGMHPGD | |
| SCHEMBL23867577 | 0.76 | HTR2A (0.51) | HTR2AHTR2CSRCDRD3 | |
| SCHEMBL23867477 | 0.74 | POLB (0.52) | HPGD | |
| SCHEMBL30234578 | 0.74 | POLB (0.52) | HPGD | |
| SCHEMBL23867522 | 0.73 | HTR2A (0.53) | HTR2AHTR2CSRCDRD3 | |
| SCHEMBL23867508 | 0.72 | ALDH1A1 (0.55) | PYGMHPGD | |
| SCHEMBL23867515 | 0.71 | POLB (0.47) | HTR2AHTR2CSRCDRD3 |
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-2021195279-A2 | SMALL MOLECULE INHIBITORS OF ONCOGENIC CHD1L WITH PRECLINICAL ACTIVITY AGAINST COLORECTAL CANCER | THE REGENTS OF THE UNIVERSITY OF COLORADO, A BODY CORPORATE (US) | 2021-09-30 | — | — | WO | disclosed |