Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 5/20 | 0.43 |
| ▸ | RAB9A | P51151 | 5/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.43 |
| ▸ | HTT | P42858 | 2/20 | 0.43 |
| ▸ | PDE4A | P27815 | 1/20 | 0.42 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.42 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.42 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 4/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.39 |
| ▸ | CES2 | O00748 | 1/20 | 0.39 |
| ▸ | CES1 | P23141 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 3/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL1710910 | 0.84 | TACR1 (0.35) | NPC1RAB9AHTTMEN1KMT2A | |
| SCHEMBL1710765 | 0.81 | KMT2A (0.34) | NPC1RAB9ASMN1; SMN2MEN1KMT2A | |
| SCHEMBL1710526 | 0.80 | MGLL (0.36) | SMN1; SMN2MEN1KMT2AMAPTALDH1A1 | |
| SCHEMBL26965397 | 0.79 | NPC1 (0.56) | NPC1RAB9ASMN1; SMN2HTTMEN1 | |
| SCHEMBL1710824 | 0.76 | CYP1A2 (0.55) | RAB9AHTTMEN1KMT2AMAPT | |
| SCHEMBL23731488 | 0.74 | NPC1 (0.54) | NPC1RAB9ASMN1; SMN2HTTMEN1 | |
| SCHEMBL3087539 | 0.72 | ELANE (0.42) | MEN1KMT2AMAPTALDH1A1GAA | |
| SCHEMBL7583060 | 0.72 | ELANE (0.42) | MEN1KMT2AMAPTALDH1A1GAA | |
| SCHEMBL30655523 | 0.72 | RAB9A (0.54) | NPC1RAB9ASMN1; SMN2HTTPDE4A | |
| SCHEMBL202288 | 0.72 | ALDH1A1 (0.69) | RAB9AMEN1KMT2AMAPTALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2344451-A2 | SULFUR-LINKED COMPOUNDS FOR TREATING OPTHALMIC DISEASES AND DISORDERS | Acucela, Inc. (US) | 2011-07-20 | — | — | EP | disclosed |