Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOA | P21397 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | PTGS1 | P23219 | 3/20 | 0.40 |
| ▸ | KDM1A | O60341 | 3/20 | 0.40 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.40 |
| ▸ | NOX1 | Q9Y5S8 | 1/20 | 0.40 |
| ▸ | BCHE | P06276 | 4/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.38 |
| ▸ | LMNA | P02545 | 3/20 | 0.38 |
| ▸ | SLC22A1 | O15245 | 2/20 | 0.38 |
| ▸ | PRNP | P04156 | 2/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.38 |
| ▸ | CHRM2 | P08172 | 2/20 | 0.38 |
| ▸ | CHRM4 | P08173 | 2/20 | 0.38 |
| ▸ | HTR1A | P08908 | 2/20 | 0.38 |
| ▸ | CHRM5 | P08912 | 2/20 | 0.38 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.38 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.38 |
| ▸ | DRD2 | P14416 | 2/20 | 0.38 |
| ▸ | ADRA2B | P18089 | 2/20 | 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 | |
|---|---|---|---|---|
| Bromide SCHEMBL29392172 | 0.71 | PTGS1 (0.54) | MAOAKMT2APTGS1KDM1APTGS2 | |
| SCHEMBL29376932 | 0.71 | KMT2A (0.52) | MAOAKMT2APTGS1KDM1APTGS2 | |
| SCHEMBL39172 | 0.71 | KMT2A (0.52) | MAOAKMT2APTGS1KDM1APTGS2 | |
| Iodide SCHEMBL11442732 | 0.69 | KMT2A (0.51) | MAOAKMT2APTGS1KDM1APTGS2 | |
| SCHEMBL3235747 | 0.68 | MAOA (0.58) | MAOAKMT2APTGS1KDM1APTGS2 | |
| SCHEMBL272974 | 0.67 | MAOA (0.52) | MAOAKMT2APTGS1KDM1APTGS2 | |
| SCHEMBL31671101 | 0.67 | MAOA (0.52) | MAOAKMT2APTGS1KDM1APTGS2 | |
| SCHEMBL5865535 | 0.67 | KMT2A (0.45) | MAOAKMT2APTGS1KDM1APTGS2 | |
| SCHEMBL9724497 | 0.66 | KDM1A (0.47) | MAOAKMT2APTGS1KDM1APTGS2 | |
| SCHEMBL3466443 | 0.64 | MAOA (0.48) | MAOAKMT2APTGS1KDM1APTGS2 |
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 |
|---|---|---|---|---|---|---|---|
| US-5104858-A | Administering trans-flupenthiyol with doxorubicin; lack of antipsychotic activity reduces side effects | YALE UNIVERSITY (US) | 1992-04-14 | — | — | US | disclosed |