Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR6 | P50406 | 1/20 | 0.45 |
| ▸ | MAP3K14 | Q99558 | 1/20 | 0.44 |
| ▸ | CCNK | O75909 | 2/20 | 0.43 |
| ▸ | CDK12 | Q9NYV4 | 2/20 | 0.43 |
| ▸ | CDK7 | P50613 | 1/20 | 0.43 |
| ▸ | CCNH | P51946 | 1/20 | 0.43 |
| ▸ | MNAT1 | P51948 | 1/20 | 0.43 |
| ▸ | SLC6A4 | P31645 | 5/20 | 0.42 |
| ▸ | SLC6A2 | P23975 | 3/20 | 0.42 |
| ▸ | SLC6A3 | Q01959 | 3/20 | 0.42 |
| ▸ | DRD2 | P14416 | 1/20 | 0.42 |
| ▸ | DRD4 | P21917 | 1/20 | 0.42 |
| ▸ | DRD3 | P35462 | 1/20 | 0.42 |
| ▸ | HTR2A | P28223 | 1/20 | 0.39 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.39 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.39 |
| ▸ | CDK2 | P24941 | 1/20 | 0.39 |
| ▸ | CDK9 | P50750 | 1/20 | 0.39 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.37 |
| ▸ | NR3C2 | P08235 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL20839263 | 0.83 | HTR6 (0.48) | HTR6MAP3K14CCNKCDK12CDK7 | |
| SCHEMBL20846200 | 0.83 | EGFR (0.50) | HTR6MAP3K14SLC6A4SLC6A2SLC6A3 | |
| SCHEMBL13323651 | 0.79 | HTR6 (0.63) | HTR6MAP3K14SLC6A4SLC6A2SLC6A3 | |
| SCHEMBL20561883 | 0.79 | HTR6 (0.46) | HTR6MAP3K14CCNKCDK12CDK7 | |
| SCHEMBL20846140 | 0.76 | MEN1 (0.45) | HTR6MAP3K14CCNKCDK12SLC6A4 | |
| SCHEMBL22578715 | 0.75 | CCNK (0.46) | HTR6MAP3K14CCNKCDK12CDK7 | |
| SCHEMBL20563079 | 0.73 | HTR6 (0.46) | HTR6MAP3K14CCNKCDK12CDK7 | |
| SCHEMBL20846161 | 0.73 | HTR6 (0.51) | HTR6MAP3K14SLC6A4SLC6A2SLC6A3 | |
| SCHEMBL7604551 | 0.72 | TRPV4 (0.56) | — | |
| SCHEMBL20562442 | 0.72 | HTR6 (0.45) | HTR6MAP3K14CCNKCDK12CDK7 |
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-2019057660-A1 | INDOLE AND AZAINDOLE COMPOUNDS WITH SUBSTITUTED 6-MEMBERED ARYL AND HETEROARYL RINGS AS AGROCHEMICAL FUNGICIDES | BASF SE (DE) | 2019-03-28 | — | — | WO | disclosed |