Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITK | Q08881 | 2/20 | 0.46 |
| ▸ | HDAC6 | Q9UBN7 | 3/20 | 0.43 |
| ▸ | HRH3 | Q9Y5N1 | 4/20 | 0.40 |
| ▸ | CCR5 | P51681 | 4/20 | 0.40 |
| ▸ | BRD4 | O60885 | 1/20 | 0.39 |
| ▸ | USP30 | Q70CQ3 | 1/20 | 0.39 |
| ▸ | CNR2 | P34972 | 4/20 | 0.39 |
| ▸ | BCHE | P06276 | 3/20 | 0.39 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.39 |
| ▸ | CNR1 | P21554 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | ACHE | P22303 | 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 | |
|---|---|---|---|---|
| SCHEMBL5315730 | 0.93 | ITK (0.46) | ITKHDAC6HRH3CCR5BRD4 | |
| SCHEMBL5318329 | 0.85 | ITK (0.51) | ITKHDAC6HRH3BRD4CNR2 | |
| SCHEMBL5318216 | 0.84 | ITK (0.43) | ITKCNR2BCHEOPRM1CNR1 | |
| SCHEMBL5315360 | 0.80 | ITK (0.43) | ITKCNR2CNR1 | |
| SCHEMBL5316323 | 0.80 | ITK (0.48) | ITKHDAC6HRH3CCR5CNR2 | |
| SCHEMBL5320022 | 0.78 | ADORA2A (0.49) | ITKHDAC6HRH3CNR2 | |
| SCHEMBL5317065 | 0.77 | JAK2 (0.47) | ITKHRH3CNR2CNR1 | |
| SCHEMBL4258690 | 0.74 | HDAC6 (0.53) | HDAC6KDM4E | |
| SCHEMBL5317545 | 0.71 | ITK (0.44) | ITKCNR2CNR1 | |
| SCHEMBL4254107 | 0.71 | KDM4E (0.51) | HDAC6KDM4E |
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-2007069053-A1 | BENZIMIDAZOLE ANTAGONISTS OF THE H-3 RECEPTOR | PFIZER PRODUCTS INC. (US) | 2007-06-21 | — | — | WO | claimed |
| WO-2007069053-A1 | BENZIMIDAZOLE ANTAGONISTS OF THE H-3 RECEPTOR | PFIZER PRODUCTS INC. (US) | 2007-06-21 | — | — | WO | disclosed |