Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 12/20 | 0.68 |
| ▸ | NPC1 | O15118 | 11/20 | 0.68 |
| ▸ | SMN1; SMN2 | Q16637 | 6/20 | 0.68 |
| ▸ | HPGD | P15428 | 5/20 | 0.65 |
| ▸ | TSHR | P16473 | 1/20 | 0.65 |
| ▸ | GPR55 | Q9Y2T6 | 1/20 | 0.65 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.63 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.63 |
| ▸ | GLA | P06280 | 1/20 | 0.63 |
| ▸ | MAPT | P10636 | 1/20 | 0.63 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.63 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.63 |
| ▸ | POLB | P06746 | 1/20 | 0.60 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.60 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.60 |
| ▸ | RELA | Q04206 | 1/20 | 0.60 |
| ▸ | MEN1 | O00255 | 1/20 | 0.60 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.60 |
| ▸ | ATAD2 | Q6PL18 | 1/20 | 0.57 |
| ▸ | GAA | P10253 | 1/20 | 0.56 |
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 | |
|---|---|---|---|---|
| SCHEMBL74999 | 0.87 | NPC1 (0.90) | RAB9ANPC1SMN1; SMN2HPGDTSHR | |
| SCHEMBL22858502 | 0.87 | NPC1 (0.90) | RAB9ANPC1SMN1; SMN2HPGDTSHR | |
| SCHEMBL522555 | 0.87 | NPC1 (0.90) | RAB9ANPC1SMN1; SMN2HPGDTSHR | |
| SCHEMBL46424 | 0.87 | NPC1 (0.90) | RAB9ANPC1SMN1; SMN2HPGDTSHR | |
| SCHEMBL1105099 | 0.85 | NPC1 (0.85) | RAB9ANPC1SMN1; SMN2HPGDTSHR | |
| SCHEMBL4343181 | 0.85 | NPC1 (0.94) | RAB9ANPC1SMN1; SMN2HPGDTSHR | |
| SCHEMBL5670474 | 0.83 | RAB9A (0.93) | RAB9ANPC1SMN1; SMN2HPGDTSHR | |
| SCHEMBL46426 | 0.82 | NPC1 (1.00) | RAB9ANPC1SMN1; SMN2HPGDTSHR | |
| SCHEMBL22036434 | 0.82 | NPC1 (0.65) | RAB9ANPC1SMN1; SMN2HPGDTSHR | |
| SCHEMBL762899 | 0.82 | NPC1 (0.65) | RAB9ANPC1SMN1; SMN2HPGDTSHR |
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-2576723-B1 | COMPOSITIONS COMPRISING QUANTUM DOTS | MERCK PATENT GMBH (DE) | 2017-09-20 | — | — | EP | disclosed |
| WO-2012084114-A1 | ORGANIC ELECTROLUMINESCENT DEVICE | MERCK PATENT GMBH (DE) | 2012-06-28 | — | — | WO | disclosed |