Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRM5 | P41594 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.39 |
| ▸ | BCL2 | P10415 | 1/20 | 0.39 |
| ▸ | BAD | Q92934 | 1/20 | 0.39 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.39 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 2/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | NCOA1 | Q15788 | 1/20 | 0.39 |
| ▸ | NCOA3 | Q9Y6Q9 | 1/20 | 0.39 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.39 |
| ▸ | DRD1 | P21728 | 1/20 | 0.39 |
| ▸ | CTSD | P07339 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | HSP90AA1 | P07900 | 2/20 | 0.38 |
| ▸ | HSP90AB1 | P08238 | 2/20 | 0.38 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.38 |
| ▸ | HSD11B1 | P28845 | 2/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL28278989 | 0.85 | NPC1 (0.56) | KMT2ABCL2HTTSMN1; SMN2RAB9A | |
| SCHEMBL29590775 | 0.83 | HSP90AA1 (0.47) | MEN1KMT2AHTTSMN1; SMN2ALDH1A1 | |
| SCHEMBL29589831 | 0.80 | OPRM1 (0.43) | OPRM1BCL2BADOPRD1OPRK1 | |
| SCHEMBL29590466 | 0.76 | HSP90AA1 (0.47) | MEN1KMT2AHTTSMN1; SMN2ALDH1A1 | |
| SCHEMBL16416972 | 0.76 | HSP90AA1 (0.47) | MEN1KMT2AHTTSMN1; SMN2ALDH1A1 | |
| SCHEMBL29591192 | 0.74 | BCL2 (0.51) | BCL2SMN1; SMN2ALDH1A1HSP90AA1HSP90AB1 | |
| SCHEMBL18970120 | 0.73 | LMNA (0.54) | MEN1KMT2AOPRM1BCL2BAD | |
| SCHEMBL1690525 | 0.73 | LMNA (0.54) | MEN1KMT2AOPRM1BCL2BAD | |
| SCHEMBL29589794 | 0.73 | BCL2 (0.57) | BCL2 | |
| SCHEMBL29590139 | 0.73 | NR1H2 (0.56) | BCL2HSP90AA1HSP90AB1TP53 |
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-109456324-A | New isoindoline or isoquinoline compound, preparation method and the Pharmaceutical composition containing them | 法国施维雅药厂 | 2019-03-12 | — | — | CN | disclosed |