Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 5/20 | 0.66 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.66 |
| ▸ | TSHR | P16473 | 2/20 | 0.56 |
| ▸ | GSK3B | P49841 | 2/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.49 |
| ▸ | MAPT | P10636 | 3/20 | 0.48 |
| ▸ | MITF | O75030 | 1/20 | 0.48 |
| ▸ | S1PR4 | O95977 | 1/20 | 0.48 |
| ▸ | TP53 | P04637 | 1/20 | 0.48 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.48 |
| ▸ | HTT | P42858 | 1/20 | 0.48 |
| ▸ | IDO1 | P14902 | 2/20 | 0.46 |
| ▸ | LMNA | P02545 | 2/20 | 0.46 |
| ▸ | ACHE | P22303 | 1/20 | 0.45 |
| ▸ | ERCC5 | P28715 | 1/20 | 0.44 |
| ▸ | FEN1 | P39748 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL18825265 | 0.82 | SMN1; SMN2 (0.66) | RAB9ASMN1; SMN2TSHRGSK3BALDH1A1 | |
| SCHEMBL18825267 | 0.81 | SMN1; SMN2 (0.81) | RAB9ASMN1; SMN2TSHRGSK3BALDH1A1 | |
| SCHEMBL12640291 | 0.81 | RAB9A (0.60) | RAB9ASMN1; SMN2TSHRALDH1A1TP53 | |
| SCHEMBL5846697 | 0.79 | SMN1; SMN2 (0.77) | RAB9ASMN1; SMN2TSHRGSK3BALDH1A1 | |
| SCHEMBL4623466 | 0.79 | GSK3A (0.54) | RAB9ASMN1; SMN2TSHRGSK3BALDH1A1 | |
| SCHEMBL18825272 | 0.78 | NPC1 (0.64) | RAB9ASMN1; SMN2GSK3BALDH1A1MAPT | |
| SCHEMBL5739537 | 0.77 | RAB9A (0.69) | RAB9ASMN1; SMN2TSHRGSK3BALDH1A1 | |
| SCHEMBL18825274 | 0.77 | RAB9A (0.59) | RAB9ASMN1; SMN2GSK3B | |
| SCHEMBL26744028 | 0.77 | RAB9A (0.59) | RAB9ASMN1; SMN2TSHRGSK3BALDH1A1 | |
| SCHEMBL22763952 | 0.76 | RAB9A (0.58) | RAB9ASMN1; SMN2TSHRKDM4E |
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-2017077550-A1 | A METAL FREE PROCESS FOR THE PREPARATION OF ALPHA-SUBSTITUTED CARBONYL COMPOUNDS FROM ALKENES | COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) | 2017-05-11 | — | — | WO | claimed |
| WO-2017077550-A1 | A METAL FREE PROCESS FOR THE PREPARATION OF ALPHA-SUBSTITUTED CARBONYL COMPOUNDS FROM ALKENES | COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) | 2017-05-11 | — | — | WO | disclosed |