Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 3/20 | 0.39 |
| ▸ | HPGD | P15428 | 2/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | TYR | P14679 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.37 |
| ▸ | PKM | P14618 | 1/20 | 0.37 |
| ▸ | GABRP | O00591 | 1/20 | 0.37 |
| ▸ | GABRD | O14764 | 1/20 | 0.37 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.37 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.37 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.37 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.37 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.37 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.37 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.37 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.37 |
| ▸ | GABRA4 | P48169 | 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 | |
|---|---|---|---|---|
| SCHEMBL4632556 | 0.84 | HTT (0.46) | HTTHPGDMAPK1NPC1RAB9A | |
| SCHEMBL1004924 | 0.79 | CTRC (0.42) | HTTHPGDMAPK1NPC1RAB9A | |
| SCHEMBL29659437 | 0.78 | ALOX5 (0.46) | HTTHPGDMAPK1NPC1RAB9A | |
| SCHEMBL29414438 | 0.78 | ALOX5 (0.46) | HTTHPGDMAPK1NPC1RAB9A | |
| SCHEMBL11483320 | 0.78 | HTT (0.42) | HTTHPGDMAPK1NPC1RAB9A | |
| SCHEMBL7308110 | 0.78 | HTT (0.42) | HTTHPGDMAPK1NPC1RAB9A | |
| SCHEMBL15324096 | 0.78 | CYP19A1 (0.44) | HTTHPGDMAPK1NPC1RAB9A | |
| SCHEMBL29037315 | 0.76 | ALOX5 (0.47) | HTTTYRTYMPMAPTMEN1 | |
| SCHEMBL250347 | 0.76 | ALOX5 (0.47) | HTTTYRTYMPMAPTMEN1 | |
| SCHEMBL6141996 | 0.75 | HTT (0.59) | HTTHPGDMAPK1NPC1RAB9A |
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-1856213-A2 | METAL OXIDE NANOPARTICLES COATED WITH SPECIFIC N-ACYLAMINOMETHYLENE PHOSPHONATES | CIBA SPECIALTY CHEMICALS HOLDING INC. Patent Departement (CH) | 2007-11-21 | — | — | EP | disclosed |
| WO-2006094915-A2 | METAL OXIDE NANOPARTICLES COATED WITH SPECIFIC N-ACYLAMINOMETHYLENE PHOSPHONATES | CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) | 2006-09-14 | — | — | WO | disclosed |