Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM1A | O60341 | 4/20 | 0.38 |
| ▸ | SLC6A2 | P23975 | 6/20 | 0.37 |
| ▸ | SLC6A4 | P31645 | 6/20 | 0.37 |
| ▸ | SLC6A3 | Q01959 | 5/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.36 |
| ▸ | BCHE | P06276 | 5/20 | 0.36 |
| ▸ | MAPT | P10636 | 3/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | MAOA | P21397 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | PTGS1 | P23219 | 3/20 | 0.35 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.35 |
| ▸ | CHRM2 | P08172 | 2/20 | 0.35 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.35 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.35 |
| ▸ | DRD1 | P21728 | 2/20 | 0.35 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.35 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL1569173 | 0.76 | TDP1 (0.37) | SLC6A2SLC6A4SLC6A3CYP1A2CYP2D6 | |
| SCHEMBL7915484 | 0.75 | BCHE (0.38) | KDM1ASLC6A2SLC6A4SLC6A3CYP1A2 | |
| SCHEMBL23039396 | 0.71 | FPR2 (0.39) | SLC6A2SLC6A4SLC6A3CYP1A2CYP2D6 | |
| SCHEMBL144450 | 0.69 | KDM1A (0.50) | KDM1ASLC6A2SLC6A4CYP1A2CYP2D6 | |
| SCHEMBL23954322 | 0.68 | MAPT (0.50) | KDM1ASLC6A2SLC6A4SLC6A3CYP1A2 | |
| SCHEMBL12386881 | 0.67 | PTGS1 (0.51) | SLC6A2SLC6A4SLC6A3CYP1A2CYP2D6 | |
| SCHEMBL1568217 | 0.67 | SLC6A2 (0.30) | SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL4595129 | 0.66 | MAOA (0.48) | KDM1ASLC6A2SLC6A4CYP1A2CYP2D6 | |
| SCHEMBL12537100 | 0.64 | KDM1A (0.47) | KDM1ASLC6A2SLC6A4SLC6A3CYP1A2 | |
| SCHEMBL38663158 | 0.64 | KDM1A (0.47) | KDM1ASLC6A2SLC6A4SLC6A3CYP1A2 |
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-2004037192-A2 | IDENTIFICATION OF ANTIMYCOBACTERIAL TARGETS AND THE INHIBITION THEREOF AS A TREATMENT FOR INFECTIOUS DISEASES | THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) | 2004-05-06 | — | — | WO | disclosed |