Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CRBN | Q96SW2 | 3/20 | 0.56 |
| ▸ | DDB1 | Q16531 | 1/20 | 0.56 |
| ▸ | HCAR1 | Q9BXC0 | 1/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.49 |
| ▸ | HPGD | P15428 | 1/20 | 0.49 |
| ▸ | GAA | P10253 | 2/20 | 0.45 |
| ▸ | LMNA | P02545 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.43 |
| ▸ | MEN1 | O00255 | 3/20 | 0.43 |
| ▸ | MAPT | P10636 | 2/20 | 0.42 |
| ▸ | NPC1 | O15118 | 2/20 | 0.42 |
| ▸ | RAB9A | P51151 | 2/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.41 |
| ▸ | ALKBH5 | Q6P6C2 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 2/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.38 |
| ▸ | ATM | Q13315 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | CASP1 | P29466 | 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 | |
|---|---|---|---|---|
| SCHEMBL23296161 | 0.84 | CRBN (0.51) | CRBNDDB1HCAR1ALDH1A1HPGD | |
| SCHEMBL3340320 | 0.84 | CRBN (0.51) | CRBNDDB1HCAR1ALDH1A1HPGD | |
| SCHEMBL848673 | 0.82 | CRBN (0.53) | CRBNDDB1HCAR1ALDH1A1HPGD | |
| SCHEMBL25553210 | 0.82 | CRBN (0.49) | CRBNDDB1HCAR1ALDH1A1HPGD | |
| SCHEMBL5325743 | 0.81 | CRBN (0.66) | CRBNDDB1HCAR1ALDH1A1HPGD | |
| SCHEMBL11478341 | 0.79 | CRBN (0.58) | CRBNDDB1HCAR1ALDH1A1HPGD | |
| SCHEMBL3340313 | 0.79 | CRBN (0.46) | CRBNDDB1HCAR1ALDH1A1HPGD | |
| SCHEMBL23120610 | 0.77 | CRBN (0.66) | CRBNDDB1HCAR1ALDH1A1LMNA | |
| SCHEMBL25551232 | 0.77 | CRBN (0.44) | CRBNDDB1HCAR1ALDH1A1MAPT | |
| SCHEMBL14685529 | 0.76 | CRBN (0.65) | CRBNDDB1ALDH1A1HPGDKMT2A |
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-2023096995-A1 | COMPOSITIONS AND METHODS COMPRISING SUBSTITUTED N-(2-CHLORO-6-METHYLPHENYL)-2-((6-(6-MEMBERED HETEROCYCLOALKYL)-2-METHYLPYRIMIDIN-4-YL)AMINO)THIAZOLE-5-CARBOXAMIDE ANALOGUES | ST. JUDE CHILDREN'S RESEARCH HOSPITAL, INC. (US) | 2023-06-01 | — | — | WO | disclosed |