Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 1/20 | 0.41 |
| ▸ | HTR2C | P28335 | 1/20 | 0.41 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.39 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.39 |
| ▸ | PDK3 | Q15120 | 1/20 | 0.39 |
| ▸ | PDK4 | Q16654 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.39 |
| ▸ | NPC1 | O15118 | 2/20 | 0.39 |
| ▸ | RAB9A | P51151 | 2/20 | 0.39 |
| ▸ | AGTR2 | P50052 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL4851246 | 0.85 | HTT (0.46) | PARP1HTR2CABCB1MEN1KMT2A | |
| SCHEMBL14936417 | 0.85 | MEN1 (0.50) | HTR2CMEN1KMT2ANPSR1HTT | |
| SCHEMBL14219041 | 0.83 | ALDH1A1 (0.46) | PARP1HTR2CABCB1MEN1KMT2A | |
| SCHEMBL4852434 | 0.82 | HTR2C (0.47) | PARP1HTR2CMEN1KMT2ANPSR1 | |
| SCHEMBL14219039 | 0.82 | HTR2C (0.47) | PARP1HTR2CMEN1KMT2ANPSR1 | |
| SCHEMBL30644090 | 0.82 | HTR2C (0.50) | PARP1HTR2CMEN1KMT2ANPSR1 | |
| SCHEMBL4850720 | 0.82 | NPC1 (0.43) | PARP1HTR2CABCB1MEN1KMT2A | |
| SCHEMBL22468567 | 0.82 | PDK1 (0.45) | PARP1HTR2CABCB1HTTPDK1 | |
| SCHEMBL15152157 | 0.82 | NR1H2 (0.40) | SMN1; SMN2HPGD | |
| SCHEMBL15114603 | 0.81 | ABCB1 (0.37) | PARP1HTR2CABCB1MEN1KMT2A |
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-3941922-A1 | INHIBITORS OF RAF KINASES | Kinnate Biopharma Inc. (US) | 2022-01-26 | — | — | EP | disclosed |