Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 7/20 | 0.41 |
| ▸ | RAB9A | P51151 | 7/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | MAPT | P10636 | 3/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | MITF | O75030 | 2/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | PTGS1 | P23219 | 3/20 | 0.37 |
| ▸ | PTGS2 | P35354 | 3/20 | 0.37 |
| ▸ | MGLL | Q99685 | 2/20 | 0.37 |
| ▸ | FAAH | O00519 | 1/20 | 0.37 |
| ▸ | GNAI3 | P08754 | 1/20 | 0.35 |
| ▸ | GNAO1 | P09471 | 1/20 | 0.35 |
| ▸ | GNAI1 | P63096 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | THRB | P10828 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 3/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL27263110 | 0.97 | NPC1 (0.42) | NPC1RAB9AALDH1A1MAPTSMN1; SMN2 | |
| SCHEMBL28203676 | 0.97 | NPC1 (0.42) | NPC1RAB9AALDH1A1MAPTSMN1; SMN2 | |
| SCHEMBL12613800 | 0.92 | ALDH1A1 (0.39) | NPC1RAB9AALDH1A1MAPTSMN1; SMN2 | |
| Hno SCHEMBL28259195 | 0.89 | NPC1 (0.41) | NPC1RAB9AALDH1A1MAPTSMN1; SMN2 | |
| SCHEMBL1132826 | 0.88 | NPC1 (0.34) | NPC1RAB9AALDH1A1MAPTSMN1; SMN2 | |
| SCHEMBL10379020 | 0.86 | PTGS1 (0.36) | NPC1RAB9AALDH1A1MAPTSMN1; SMN2 | |
| SCHEMBL18838747 | 0.86 | NPC1 (0.44) | NPC1RAB9AALDH1A1MAPTSMN1; SMN2 | |
| SCHEMBL4270037 | 0.83 | TSHR (0.47) | NPC1RAB9AALDH1A1MAPTSMN1; SMN2 | |
| SCHEMBL4274617 | 0.83 | TSHR (0.47) | NPC1RAB9AALDH1A1MAPTSMN1; SMN2 | |
| SCHEMBL4270831 | 0.83 | TSHR (0.47) | NPC1RAB9AALDH1A1MAPTSMN1; SMN2 |
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-2003054037-A1 | COMPLEXES BASED ON HETERO-CYCLOBUTENYL LIGANDS | EQUISTAR CHEMICALS, LP (US) | 2003-07-03 | — | — | WO | disclosed |
| US-6586545-B1 | Olefin polymerization catalyst, activator and complex of metal and heterocyclobetenyl ligand | EQUISTAR CHEMICALS, LP | 2003-07-01 | — | — | US | disclosed |