Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AHR | P35869 | 3/20 | 0.49 |
| ▸ | CMA1 | P23946 | 1/20 | 0.49 |
| ▸ | BRAF | P15056 | 1/20 | 0.43 |
| ▸ | BRD4 | O60885 | 1/20 | 0.42 |
| ▸ | APP | P05067 | 1/20 | 0.42 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.41 |
| ▸ | CHRNA7 | P36544 | 2/20 | 0.41 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.41 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.41 |
| ▸ | CHRNA10 | Q9GZZ6 | 1/20 | 0.41 |
| ▸ | CHRNA9 | Q9UGM1 | 1/20 | 0.41 |
| ▸ | KMO | O15229 | 2/20 | 0.41 |
| ▸ | TYR | P14679 | 1/20 | 0.41 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.40 |
| ▸ | MPO | P05164 | 1/20 | 0.40 |
| ▸ | TPO | P07202 | 1/20 | 0.40 |
| ▸ | DYRK1B | Q9Y463 | 1/20 | 0.40 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.40 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.40 |
| ▸ | SYK | P43405 | 2/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL3400660 | 0.87 | AHR (0.49) | AHRBRAFBRD4APPKMO | |
| SCHEMBL9213361 | 0.77 | MAPT (0.51) | BRD4APPKDM4CADORA2AADORA1 | |
| SCHEMBL29445919 | 0.75 | BRAF (0.47) | AHRCMA1BRAFBRD4APP | |
| SCHEMBL19133030 | 0.75 | MAP4K4 (0.47) | KMOKCNH2 | |
| SCHEMBL445861 | 0.75 | MEN1 (0.52) | KMO | |
| SCHEMBL27084041 | 0.74 | CCR1 (0.50) | AHRCMA1BRAFBRD4KDM4C | |
| SCHEMBL7544652 | 0.74 | KMO (0.69) | AHRKMODYRK1B | |
| SCHEMBL12520573 | 0.73 | SYK (0.47) | AHRCMA1APPSYKAURKA | |
| SCHEMBL27361728 | 0.73 | BRD4 (0.46) | AHRCMA1BRAFBRD4APP | |
| SCHEMBL18828549 | 0.73 | BACE1 (0.47) | AHRCMA1BRAFBRD4APP |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2008060248-A1 | INDOLE SUSTITUTED PYRIMIDINES AND USE THEREOF IN THE TREATMENT OF CANCER | S*BIO PTE LTD. (SG) | 2008-05-22 | — | — | WO | disclosed |
| WO-2008060248-A1 | INDOLE SUSTITUTED PYRIMIDINES AND USE THEREOF IN THE TREATMENT OF CANCER | S*BIO PTE LTD. (SG) | 2008-05-22 | — | — | WO | disclosed |