Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR1 | P32246 | 1/20 | 0.39 |
| ▸ | ADORA2A | P29274 | 4/20 | 0.36 |
| ▸ | ADORA1 | P30542 | 4/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.34 |
| ▸ | MEN1 | O00255 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | TRIM24 | O15164 | 1/20 | 0.34 |
| ▸ | TRIM33 | Q9UPN9 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | ATM | Q13315 | 1/20 | 0.33 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.31 |
| ▸ | FGFR4 | P22455 | 1/20 | 0.30 |
| ▸ | RRM2 | P31350 | 1/20 | 0.30 |
| ▸ | GAA | P10253 | 1/20 | 0.30 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.30 |
| ▸ | PRMT5 | O14744 | 1/20 | 0.30 |
| ▸ | WDR77 | Q9BQA1 | 1/20 | 0.30 |
| ▸ | BTK | Q06187 | 1/20 | 0.30 |
| ▸ | ITK | Q08881 | 1/20 | 0.30 |
| ▸ | PDE4A | P27815 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL29600275 | 0.79 | CCR1 (0.39) | CCR1ADORA2AADORA1KMT2AALDH1A1 | |
| SCHEMBL24323860 | 0.79 | CCR1 (0.39) | CCR1ADORA2AADORA1KMT2AALDH1A1 | |
| SCHEMBL15333269 | 0.76 | CDK5 (0.46) | ADORA2AADORA1KMT2AMEN1ALDH1A1 | |
| SCHEMBL7922469 | 0.75 | ADORA2A (0.53) | ADORA2AADORA1KMT2AMEN1ALDH1A1 | |
| SCHEMBL13834371 | 0.75 | LRRK2 (0.49) | CCR1PRMT5WDR77 | |
| SCHEMBL29956652 | 0.73 | AXL (0.45) | MAPK1BTKITK | |
| SCHEMBL21589019 | 0.72 | ADORA2A (0.40) | ADORA2AADORA1KMT2AMEN1ALDH1A1 | |
| SCHEMBL11467387 | 0.71 | CSNK2A2 (0.48) | ADORA2AADORA1KMT2AMEN1ALDH1A1 | |
| SCHEMBL6176944 | 0.68 | CCR1 (0.54) | CCR1KMT2AMEN1ALDH1A1KDM4E | |
| SCHEMBL24096805 | 0.68 | NR4A2 (0.44) | KMT2AMEN1ALDH1A1KDM4EMAPK1 |
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-2022076622-A2 | MODULATORS OF CYSTIC FIBROSIS TRANSMEMBRANE CONDUCTANCE REGULATOR | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2022-04-14 | — | — | WO | disclosed |