Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 1/20 | 0.40 |
| ▸ | CA1 | P00915 | 1/20 | 0.40 |
| ▸ | CA2 | P00918 | 1/20 | 0.40 |
| ▸ | CA9 | Q16790 | 1/20 | 0.40 |
| ▸ | NOTUM | Q6P988 | 2/20 | 0.38 |
| ▸ | LRRK2 | Q5S007 | 3/20 | 0.36 |
| ▸ | BRD4 | O60885 | 2/20 | 0.34 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.34 |
| ▸ | BACE1 | P56817 | 2/20 | 0.33 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 2/20 | 0.32 |
| ▸ | RAB9A | P51151 | 2/20 | 0.32 |
| ▸ | CASP3 | P42574 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.32 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.32 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | GLA | P06280 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL21939245 | 0.78 | NOTUM (0.43) | CA12CA1CA2CA9NOTUM | |
| SCHEMBL13451187 | 0.75 | NOTUM (0.46) | NOTUMBACE1NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL13103800 | 0.74 | NOTUM (0.42) | CA12CA1CA2CA9NOTUM | |
| SCHEMBL16573949 | 0.74 | NOTUM (0.45) | CA12CA1CA2CA9NOTUM | |
| SCHEMBL26206906 | 0.74 | NOTUM (0.45) | CA12CA1CA2CA9NOTUM | |
| SCHEMBL21958452 | 0.72 | LRRK2 (0.48) | CA12CA1CA2CA9NOTUM | |
| SCHEMBL8103862 | 0.71 | NOTUM (0.40) | CA12CA1CA2CA9NOTUM | |
| SCHEMBL4287576 | 0.71 | GPR84 (0.40) | CA12CA1CA2CA9NOTUM | |
| SCHEMBL1187141 | 0.71 | ESR1 (0.47) | NOTUM | |
| SCHEMBL2898396 | 0.71 | NOTUM (0.43) | CA12CA1CA2CA9NOTUM |
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-2009058919-A1 | CCR5 ANTAGONISTS AS THERAPEUTIC AGENTS | SMITHKLINE BEECHAM CORPORATION (US) | 2009-05-07 | — | — | WO | disclosed |