Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 2/20 | 0.52 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.52 |
| ▸ | TRPM8 | Q7Z2W7 | 3/20 | 0.40 |
| ▸ | LTB4R | Q15722 | 1/20 | 0.40 |
| ▸ | LTB4R2 | Q9NPC1 | 1/20 | 0.40 |
| ▸ | PTGS1 | P23219 | 3/20 | 0.39 |
| ▸ | PTGS2 | P35354 | 3/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | APP | P05067 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.35 |
| ▸ | PTBP1 | P26599 | 1/20 | 0.35 |
| ▸ | P2RX1 | P51575 | 1/20 | 0.35 |
| ▸ | P2RX3 | P56373 | 1/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
| ▸ | P2RX4 | Q99571 | 1/20 | 0.35 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.35 |
| ▸ | BCHE | P06276 | 1/20 | 0.34 |
| ▸ | MAOA | P21397 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL4276500 | 1.00 | NPC1 (0.52) | NPC1L3MBTL1TRPM8LTB4RLTB4R2 | |
| SCHEMBL4266852 | 0.84 | TRPM8 (0.36) | NPC1L3MBTL1TRPM8PTGS1PTGS2 | |
| SCHEMBL4266849 | 0.84 | TRPM8 (0.36) | NPC1L3MBTL1TRPM8PTGS1PTGS2 | |
| SCHEMBL4270776 | 0.78 | HCAR2 (0.44) | L3MBTL1PTGS1PTGS2ALDH1A1RAB9A | |
| SCHEMBL4264349 | 0.78 | HCAR2 (0.44) | L3MBTL1PTGS1PTGS2ALDH1A1RAB9A | |
| Pyrrole SCHEMBL4268503 | 0.74 | HDAC3 (0.38) | PTGS1PTGS2ALDH1A1RAB9AMAOA | |
| SCHEMBL4271070 | 0.73 | HPGD (0.48) | PTGS1PTGS2ALDH1A1SMN1; SMN2 | |
| SCHEMBL4271068 | 0.73 | HPGD (0.48) | PTGS1PTGS2ALDH1A1SMN1; SMN2 | |
| SCHEMBL29359309 | 0.73 | HPGD (0.48) | PTGS1PTGS2ALDH1A1SMN1; SMN2 | |
| SCHEMBL4273124 | 0.73 | EGFR (0.58) | L3MBTL1APP |
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 |
|---|---|---|---|---|---|---|---|
| WO-2009110002-A1 | NOVEL EFFLUX PUMP INHIBITORS | COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) | 2009-09-11 | — | — | WO | claimed |
| WO-2009110002-A1 | NOVEL EFFLUX PUMP INHIBITORS | COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) | 2009-09-11 | — | — | WO | disclosed |