Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TNKS | O95271 | 1/20 | 0.50 |
| ▸ | TNKS2 | Q9H2K2 | 1/20 | 0.50 |
| ▸ | PGR | P06401 | 11/20 | 0.47 |
| ▸ | PDE7A | Q13946 | 2/20 | 0.42 |
| ▸ | BACE1 | P56817 | 1/20 | 0.38 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.38 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.37 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.37 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL24481758 | 0.98 | TNKS (0.51) | TNKSTNKS2PGRPDE7ABACE1 | |
| SCHEMBL15004855 | 0.95 | TNKS (0.51) | TNKSTNKS2PGRPDE7ABACE1 | |
| SCHEMBL31472145 | 0.95 | TNKS (0.51) | TNKSTNKS2PGRPDE7ABACE1 | |
| SCHEMBL3866633 | 0.91 | TNKS (0.50) | TNKSTNKS2PGRPDE7ABACE1 | |
| SCHEMBL31472193 | 0.91 | TNKS (0.50) | TNKSTNKS2PGRPDE7ABACE1 | |
| SCHEMBL20954874 | 0.85 | BACE1 (0.51) | TNKSTNKS2PGRBACE1OPRM1 | |
| SCHEMBL15650376 | 0.83 | TNKS (0.46) | TNKSTNKS2PGRBACE1HDAC4 | |
| SCHEMBL5481718 | 0.81 | PGR (0.49) | TNKSTNKS2PGRPDE7A | |
| SCHEMBL4719333 | 0.81 | PDE7A (0.57) | TNKSTNKS2PGRPDE7ABACE1 | |
| SCHEMBL30881935 | 0.77 | PGR (0.46) | TNKSTNKS2PGRPDE7ABACE1 |
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-1931631-A1 | 1- (1H- INDOL- 1-YL) -3- (METHYLAMINO) -1- PHENYLPROPAN-2-OL DERIVATIVES AND RELATED COMPOUNDS AS MODULATORS OF THE MONOAMINE REUPTAKE FOR THE TREATMENT OF VASOMOTOR SYMPTOMS (VMS) | Wyeth a Corporation of the State of Delaware (US) | 2008-06-18 | — | — | EP | disclosed |
| WO-2007041023-A1 | 1- (1H- INDOL- 1-YL) -3- (METHYLAMINO) -1- PHENYLPROPAN-2-OL DERIVATIVES AND RELATED COMPOUNDS AS MODULATORS OF THE MONOAMINE REUPTAKE FOR THE TREATMENT OF VASOMOTOR SYMPTOMS (VMS) | WYETH (US) | 2007-04-12 | — | — | WO | disclosed |