Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TNF | P01375 | 3/20 | 0.51 |
| ▸ | IL6 | P05231 | 3/20 | 0.51 |
| ▸ | MYC | P01106 | 1/20 | 0.43 |
| ▸ | MAX | P61244 | 1/20 | 0.43 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.38 |
| ▸ | CCR3 | P51677 | 1/20 | 0.37 |
| ▸ | CYP24A1 | Q07973 | 1/20 | 0.36 |
| ▸ | GRIN2D | O15399 | 2/20 | 0.36 |
| ▸ | GRIN3B | O60391 | 2/20 | 0.36 |
| ▸ | GRIN1 | Q05586 | 2/20 | 0.36 |
| ▸ | GRIN2A | Q12879 | 2/20 | 0.36 |
| ▸ | GRIN2B | Q13224 | 2/20 | 0.36 |
| ▸ | GRIN2C | Q14957 | 2/20 | 0.36 |
| ▸ | GRIN3A | Q8TCU5 | 2/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | HTR2C | P28335 | 2/20 | 0.34 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.34 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 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 | |
|---|---|---|---|---|
| SCHEMBL8911935 | 0.82 | RXRA (0.35) | TNFIL6HPGDNPSR1MEN1 | |
| SCHEMBL28210997 | 0.78 | TNF (0.51) | TNFIL6MYCMAXNFKB1 | |
| SCHEMBL28211054 | 0.76 | TNF (0.68) | TNFIL6MYCMAXNFKB1 | |
| SCHEMBL1891515 | 0.76 | TP53 (0.41) | NFKB1LMNAHPGDMEN1CYP1A2 | |
| SCHEMBL1891513 | 0.76 | TP53 (0.41) | NFKB1LMNAHPGDMEN1CYP1A2 | |
| SCHEMBL5766522 | 0.76 | HSD11B1 (0.47) | CCR3MEN1KMT2A | |
| SCHEMBL3855365 | 0.73 | CYP26A1 (0.37) | CCR3GRIN2DGRIN3BGRIN1GRIN2A | |
| SCHEMBL5015224 | 0.72 | TNF (0.51) | TNFIL6MYCMAXNFKB1 | |
| SCHEMBL28211553 | 0.72 | MYC (0.49) | TNFIL6MYCMAXNFKB1 | |
| SCHEMBL25375799 | 0.72 | TNF (0.59) | TNFIL6MYCMAXNFKB1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-105037252-B | N- substitutions -3,5- two (2- (trifluoromethyl) benzal) piperidin-4-one-derivative and preparation method and application | 温州医科大学 | 2018-05-04 | — | — | CN | disclosed |
| CN-105037252-B | N- substitutions -3,5- two (2- (trifluoromethyl) benzal) piperidin-4-one-derivative and preparation method and application | 温州医科大学 | 2018-05-04 | — | — | CN | disclosed |