Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.30 |
| ▸ | GAA | P10253 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL78216 | 0.79 | SMN1; SMN2 (0.38) | CYP3A4 | |
| SCHEMBL79258 | 0.73 | CA2 (0.36) | — | |
| SCHEMBL6123665 | 0.70 | PTGS2 (0.41) | NPC1HPGDMAPK1HTTRAB9A | |
| SCHEMBL10790893 | 0.70 | NPC1 (0.40) | NPC1HPGDMAPK1HTTRAB9A | |
| SCHEMBL21362456 | 0.69 | GAA (0.47) | NPC1HPGDMAPK1HTTRAB9A | |
| SCHEMBL10904829 | 0.69 | NPC1 (0.35) | NPC1HPGDMAPK1HTTRAB9A | |
| SCHEMBL10791363 | 0.69 | NPC1 (0.35) | NPC1HPGDMAPK1HTTRAB9A | |
| SCHEMBL39321 | 0.68 | GAA (0.55) | NPC1HPGDMAPK1HTTRAB9A | |
| SCHEMBL7758054 | 0.68 | NPC1 (0.42) | NPC1HPGDMAPK1HTTRAB9A | |
| SCHEMBL585549 | 0.66 | SMN1; SMN2 (0.38) | CYP3A4 |
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-6767976-B2 | POLYMERIZING METHACRYLIC ESTER OR ACRYLIC ESTER ANIONICALLY, USING A POLYMERIZATION INITIATOR COMPRISING ADDITION REACTION PRODUCT OF CONJUGATED DIENE COMPOUND AND ORGANIC ALKALI METAL COMPOUND AND TERTIARY ORGANOALUMINUM COMPOUND | KURARAY CO., LTD. (JP) | 2004-07-27 | — | — | US | claimed |