Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CNR2 | P34972 | 2/20 | 0.48 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.47 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.47 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.47 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.47 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.47 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.47 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.47 |
| ▸ | NCOR2 | Q9Y618 | 1/20 | 0.47 |
| ▸ | CNR1 | P21554 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.42 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.42 |
| ▸ | OPRD1 | P41143 | 2/20 | 0.42 |
| ▸ | OPRK1 | P41145 | 2/20 | 0.42 |
| ▸ | TP53 | P04637 | 2/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL658329 | 0.94 | HDAC3 (0.49) | HDAC3HDAC4HDAC1HDAC2HDAC10 | |
| SCHEMBL657674 | 0.89 | CNR2 (0.58) | CNR2HDAC3HDAC4HDAC1HDAC2 | |
| SCHEMBL657503 | 0.85 | SMN1; SMN2 (0.57) | CNR2MEN1KMT2ASMN1; SMN2HTT | |
| SCHEMBL657435 | 0.82 | HDAC1 (0.56) | CNR2HDAC3HDAC4HDAC1HDAC2 | |
| SCHEMBL657249 | 0.76 | CNR2 (0.56) | CNR2HDAC3HDAC4HDAC1HDAC2 | |
| SCHEMBL13386233 | 0.76 | CNR2 (0.63) | CNR2HDAC3HDAC4HDAC1HDAC2 | |
| SCHEMBL657957 | 0.76 | SMN1; SMN2 (0.66) | CNR2HDAC3HDAC4HDAC1HDAC2 | |
| SCHEMBL657395 | 0.73 | SMN1; SMN2 (0.61) | CNR2HDAC3HDAC4HDAC1HDAC2 | |
| SCHEMBL5758222 | 0.73 | OPRM1 (0.53) | SMN1; SMN2ALDH1A1OPRM1OPRD1OPRK1 | |
| SCHEMBL656749 | 0.73 | ALDH1A1 (0.46) | ALDH1A1TP53CYP2C9TSHRLMNA |
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 |
|---|---|---|---|---|---|---|---|
| EP-2349999-A1 | ALLOSTERIC PROTEIN KINASE MODULATORS | Universität des Saarlandes (DE) | 2011-08-03 | — | — | EP | claimed |
| WO-2010043711-A1 | ALLOSTERIC PROTEIN KINASE MODULATORS | UNIVERSITAET DES SAARLANDES (DE) | 2010-04-22 | — | — | WO | claimed |