Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CFTR | P13569 | 3/20 | 0.36 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.36 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.36 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.34 |
| ▸ | HTT | P42858 | 2/20 | 0.34 |
| ▸ | TP53 | P04637 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | MAP3K5 | Q99683 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.33 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL28946943 | 0.86 | CFTR (0.35) | CFTRNPSR1SMN1; SMN2CYP1A2KDM4E | |
| SCHEMBL31429362 | 0.82 | NPC1 (0.46) | SMN1; SMN2KDM4EHTTALDH1A1NPC1 | |
| SCHEMBL7510800 | 0.82 | PDE10A (0.42) | CFTRADORA3ADORA2AADORA1SMN1; SMN2 | |
| SCHEMBL3059091 | 0.81 | ALDH1A1 (0.50) | NPSR1SMN1; SMN2CYP1A2KDM4EHTT | |
| SCHEMBL7509900 | 0.79 | PDE10A (0.41) | ADORA3ADORA2AADORA1SMN1; SMN2KDM4E | |
| SCHEMBL27912638 | 0.79 | ALDH1A1 (0.45) | SMN1; SMN2KDM4EHTTPOLBALDH1A1 | |
| SCHEMBL1664763 | 0.78 | LRRK2 (0.37) | MAP3K5PDE10A | |
| SCHEMBL19208770 | 0.76 | ENPP2 (0.36) | ADORA3ADORA2AADORA1NPSR1SMN1; SMN2 | |
| SCHEMBL17459117 | 0.75 | KMT2A (0.43) | NPSR1SMN1; SMN2CYP1A2KDM4EHTT | |
| Dimethylformamide SCHEMBL27895442 | 0.75 | ADORA3 (0.32) | ADORA3PDE10AHDAC9 |
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 |
|---|---|---|---|---|---|---|---|
| CN-102947292-A | nitrogen-containing heteroaryl compounds | HOFFMANN LA ROCHE | 2013-02-27 | — | — | CN | disclosed |