Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CASP2 | P42575 | 1/20 | 0.63 |
| ▸ | NAAA | Q02083 | 1/20 | 0.59 |
| ▸ | EPHX1 | P07099 | 5/20 | 0.56 |
| ▸ | FAAH | O00519 | 4/20 | 0.55 |
| ▸ | CNR1 | P21554 | 1/20 | 0.53 |
| ▸ | DNM1 | Q05193 | 2/20 | 0.52 |
| ▸ | MEN1 | O00255 | 1/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.50 |
| ▸ | HPGD | P15428 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL8748159 | 0.98 | CASP2 (0.61) | CASP2NAAAEPHX1FAAHCNR1 | |
| SCHEMBL12791861 | 0.92 | CASP2 (0.71) | CASP2NAAAEPHX1FAAHCNR1 | |
| SCHEMBL889319 | 0.92 | CASP2 (0.71) | CASP2NAAAEPHX1FAAHCNR1 | |
| SCHEMBL889187 | 0.91 | CASP2 (0.53) | CASP2NAAAEPHX1FAAHCNR1 | |
| SCHEMBL15044740 | 0.91 | CASP2 (0.77) | CASP2NAAAEPHX1FAAHDNM1 | |
| SCHEMBL24412632 | 0.90 | CASP2 (0.74) | CASP2NAAAEPHX1FAAHDNM1 | |
| SCHEMBL12792037 | 0.90 | CASP2 (0.74) | CASP2NAAAEPHX1FAAHDNM1 | |
| SCHEMBL12792186 | 0.90 | CASP2 (0.74) | CASP2NAAAEPHX1FAAHDNM1 | |
| SCHEMBL12791762 | 0.90 | CASP2 (0.74) | CASP2NAAAEPHX1FAAHDNM1 | |
| SCHEMBL12791694 | 0.90 | CASP2 (0.74) | CASP2NAAAEPHX1FAAHDNM1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0700380-B1 | N-ALKYLTHIO POLYAMINE DERIVATIVES AS RADIOPROTECTIVE AGENTS | MERRELL PHARMA INC (US) | 1998-06-24 | — | — | EP | disclosed |
| EP-0700380-A1 | N-ALKYLTHIO POLYAMINE DERIVATIVES AS RADIOPROTECTIVE AGENTS | MERRELL PHARMACEUTICALS INC. (US) | 1996-03-13 | — | — | EP | disclosed |
| US-5434145-A | N-alkythio polyamine derivatives as radioprotective agents | MERRELL DOW PHARMACEUTICALS INC. (US) | 1995-07-18 | — | — | US | disclosed |
| WO-1994027961-A1 | N-ALKYLTHIO POLYAMINE DERIVATIVES AS RADIOPROTECTIVE AGENTS | MERRELL DOW PHARMACEUTIALS INC. (US) | 1994-12-08 | — | — | WO | disclosed |