Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | MDM2 | Q00987 | 2/20 | 0.41 |
| ▸ | CRACR2A | Q9BSW2 | 1/20 | 0.41 |
| ▸ | BCL2 | P10415 | 1/20 | 0.41 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.41 |
| ▸ | GSK3B | P49841 | 1/20 | 0.40 |
| ▸ | BACE1 | P56817 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.39 |
| ▸ | MMP1 | P03956 | 1/20 | 0.39 |
| ▸ | KCNJ6 | P48051 | 1/20 | 0.39 |
| ▸ | KCNJ5 | P48544 | 1/20 | 0.39 |
| ▸ | KCNJ3 | P48549 | 1/20 | 0.39 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.39 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.39 |
| ▸ | MAP3K7 | O43318 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL1131754 | 1.00 | KDM4E (0.42) | KDM4ESMN1; SMN2KMT2AMDM2CRACR2A | |
| SCHEMBL1131667 | 0.91 | KDM4E (0.44) | KDM4ESMN1; SMN2KMT2AMDM2CRACR2A | |
| SCHEMBL1131668 | 0.91 | KDM4E (0.44) | KDM4ESMN1; SMN2KMT2AMDM2CRACR2A | |
| SCHEMBL1131251 | 0.84 | CA12 (0.43) | KDM4EKMT2ACRACR2AALDH1A1HPGD | |
| SCHEMBL1131257 | 0.84 | CA12 (0.43) | KDM4EKMT2ACRACR2AALDH1A1HPGD | |
| SCHEMBL1131017 | 0.83 | MDM2 (0.43) | KDM4ESMN1; SMN2KMT2AMDM2CRACR2A | |
| SCHEMBL1131756 | 0.83 | KDM4E (0.43) | KDM4ESMN1; SMN2KMT2AMDM2CRACR2A | |
| SCHEMBL1132002 | 0.83 | KDM4E (0.43) | KDM4ESMN1; SMN2KMT2AMDM2CRACR2A | |
| SCHEMBL1132075 | 0.81 | MDM2 (0.60) | KDM4ESMN1; SMN2KMT2AMDM2CRACR2A | |
| SCHEMBL1131566 | 0.80 | SMN1; SMN2 (0.42) | KDM4ESMN1; SMN2KMT2AMDM2CRACR2A |
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-1663105-B1 | CYCLOALKYL HETEROCYCLES FOR TREATING HEPATITIS C VIRUS | BRISTOL MYERS SQUIBB CO (US) | 2011-02-16 | — | — | EP | claimed |
| EP-1663105-B1 | CYCLOALKYL HETEROCYCLES FOR TREATING HEPATITIS C VIRUS | BRISTOL MYERS SQUIBB CO (US) | 2011-02-16 | — | — | EP | disclosed |