Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRD4 | O60885 | 3/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | KLKB1 | P03952 | 2/20 | 0.40 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.39 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.39 |
| ▸ | P2RX7 | Q99572 | 8/20 | 0.39 |
| ▸ | CRHBP | P24387 | 1/20 | 0.38 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.38 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.38 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.38 |
| ▸ | NOTUM | Q6P988 | 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 | |
|---|---|---|---|---|
| Trifluoroacetic Acid SCHEMBL4737901 | 0.83 | BRD4 (0.51) | BRD4KLKB1RIPK1P2RX7NOTUM | |
| SCHEMBL17241086 | 0.83 | P2RX7 (0.46) | BRD4ALDH1A1LMNAKLKB1RIPK1 | |
| SCHEMBL16862955 | 0.82 | ALDH1A1 (0.60) | ALDH1A1LMNACYP19A1P2RX7CRHBP | |
| SCHEMBL4734075 | 0.80 | BRD4 (0.57) | BRD4ALDH1A1LMNARIPK1P2RX7 | |
| SCHEMBL4024290 | 0.78 | SMN1; SMN2 (0.47) | BRD4ALDH1A1LMNAKLKB1RIPK1 | |
| SCHEMBL16862950 | 0.77 | BRD4 (0.59) | BRD4KLKB1RIPK1P2RX7NOTUM | |
| SCHEMBL4733561 | 0.77 | KMT2A (0.35) | ALDH1A1LMNAGABRA2GABRB2 | |
| SCHEMBL4734971 | 0.77 | PTGER1 (0.43) | GABRA2GABRB2 | |
| SCHEMBL4737902 | 0.76 | RBP4 (0.46) | KLKB1RIPK1 | |
| SCHEMBL4737129 | 0.76 | ACACB (0.31) | GABRA2GABRB2NOTUM |
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 |
|---|---|---|---|---|---|---|---|
| WO-2008073461-A2 | ION CHANNEL MODULATORS | WYETH (US) | 2008-06-19 | — | — | WO | disclosed |