Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BCL2L1 | Q07817 | 1/20 | 0.42 |
| ▸ | BAD | Q92934 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.33 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | KCNK2 | O95069 | 1/20 | 0.33 |
| ▸ | KCNK10 | P57789 | 1/20 | 0.33 |
| ▸ | KCNK18 | Q7Z418 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | CES1 | P23141 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 2/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.31 |
| ▸ | MAOA | P21397 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL4974372 | 0.80 | BCL2L1 (0.60) | BCL2L1BADTSHRALDH1A1MEN1 | |
| Bromide SCHEMBL7104246 | 0.78 | BCL2L1 (0.58) | BCL2L1BADTSHRALDH1A1MEN1 | |
| SCHEMBL8661517 | 0.77 | CES1 (0.43) | BCL2L1BADTSHRCES1 | |
| SCHEMBL17698887 | 0.75 | BCL2L1 (0.54) | BCL2L1BADTSHRMEN1KMT2A | |
| SCHEMBL29488244 | 0.75 | BCL2L1 (0.54) | BCL2L1BADTSHRMEN1KMT2A | |
| SCHEMBL27486701 | 0.75 | ALDH1A1 (0.35) | BCL2L1BADTSHRALDH1A1MEN1 | |
| SCHEMBL27717319 | 0.74 | PRCP (0.41) | BCL2L1ALDH1A1HPGDCYP2A6 | |
| SCHEMBL29514531 | 0.73 | HTR7 (0.40) | TSHRALDH1A1TDP1HPGDHTT | |
| SCHEMBL27612010 | 0.72 | CES1 (0.40) | BCL2L1BADCES1 | |
| SCHEMBL19692682 | 0.71 | PARP1 (0.34) | TSHRALDH1A1CYP2A6 |
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-106458897-A | Process for producing heterocyclic compound | 武田药品工业株式会社 | 2017-02-22 | — | — | CN | disclosed |