Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 2/20 | 0.53 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.53 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.50 |
| ▸ | CXCL12 | P48061 | 3/20 | 0.49 |
| ▸ | DHODH | Q02127 | 1/20 | 0.48 |
| ▸ | BACE1 | P56817 | 1/20 | 0.47 |
| ▸ | MAOB | P27338 | 4/20 | 0.47 |
| ▸ | MAOA | P21397 | 2/20 | 0.47 |
| ▸ | MAPT | P10636 | 2/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.47 |
| ▸ | CYP1B1 | Q16678 | 2/20 | 0.47 |
| ▸ | PTPN5 | P54829 | 1/20 | 0.47 |
| ▸ | GUSB | P08236 | 1/20 | 0.46 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL7172457 | 1.00 | PTGS2 (0.53) | PTGS2PTGS1ABCG2CXCL12DHODH | |
| SCHEMBL7170696 | 0.91 | MAPT (0.56) | PTGS2PTGS1ABCG2CXCL12BACE1 | |
| SCHEMBL7171726 | 0.91 | CXCL12 (0.58) | PTGS2CXCL12DHODHBACE1MAOB | |
| SCHEMBL7171724 | 0.91 | CXCL12 (0.58) | PTGS2CXCL12DHODHBACE1MAOB | |
| SCHEMBL7170699 | 0.91 | MAPT (0.56) | PTGS2PTGS1ABCG2CXCL12BACE1 | |
| SCHEMBL1225321 | 0.84 | PTPN5 (0.58) | PTGS2PTGS1ABCG2CXCL12BACE1 | |
| SCHEMBL1225320 | 0.84 | PTPN5 (0.58) | PTGS2PTGS1ABCG2CXCL12BACE1 | |
| SCHEMBL30384257 | 0.84 | PTPN5 (0.58) | PTGS2PTGS1ABCG2CXCL12BACE1 | |
| SCHEMBL1225024 | 0.82 | MAPT (0.59) | CXCL12DHODHBACE1MAOBMAOA | |
| SCHEMBL30383707 | 0.82 | MAPT (0.59) | CXCL12DHODHBACE1MAOBMAOA |
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-1355921-A2 | MODULATORS OF CELLULAR PROLIFERATION AND ANGIOGENESIS, METHODS FOR USE AND IDENTIFICATION THEREOF | North Shore-Long Island Jewish Health System (US) | 2003-10-29 | — | — | EP | disclosed |
| WO-2002002593-A2 | MODULATORS OF CELLULAR PROLIFERATION AND ANGIOGENESIS, METHODS FOR USE AND IDENTIFICATION THEREOF | NORTH SHORE-LONG ISLAND JEWISH HEALTH SYSTEM (US) | 2002-01-10 | — | — | WO | disclosed |