Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.47 |
| ▸ | JAK2 | O60674 | 1/20 | 0.47 |
| ▸ | RAB9A | P51151 | 1/20 | 0.47 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.47 |
| ▸ | ICMT | O60725 | 2/20 | 0.44 |
| ▸ | ALB | P02768 | 2/20 | 0.44 |
| ▸ | CNR2 | P34972 | 2/20 | 0.42 |
| ▸ | CES2 | O00748 | 1/20 | 0.41 |
| ▸ | CES1 | P23141 | 1/20 | 0.41 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.41 |
| ▸ | NAAA | Q02083 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | TACR1 | P25103 | 1/20 | 0.40 |
| ▸ | DRD2 | P14416 | 1/20 | 0.40 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.40 |
| ▸ | DRD3 | P35462 | 1/20 | 0.40 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL235905 | 1.00 | NPC1 (0.47) | NPC1JAK2RAB9APAX8ICMT | |
| SCHEMBL233200 | 1.00 | NPC1 (0.47) | NPC1JAK2RAB9APAX8ICMT | |
| SCHEMBL235953 | 1.00 | NPC1 (0.47) | NPC1JAK2RAB9APAX8ICMT | |
| SCHEMBL235949 | 1.00 | NPC1 (0.47) | NPC1JAK2RAB9APAX8ICMT | |
| SCHEMBL7140261 | 0.88 | NPC1 (0.44) | NPC1JAK2RAB9APAX8ICMT | |
| SCHEMBL31310571 | 0.78 | NPC1 (0.44) | NPC1JAK2RAB9APAX8ICMT | |
| SCHEMBL30957375 | 0.78 | KMT2A (0.43) | ALDH1A1DRD2OPRM1DRD3SIGMAR1 | |
| SCHEMBL5616072 | 0.76 | NPC1 (0.43) | NPC1JAK2RAB9APAX8ICMT | |
| SCHEMBL27492571 | 0.75 | ZDHHC20 (0.43) | NPC1JAK2RAB9APAX8ICMT | |
| SCHEMBL235171 | 0.74 | ALDH1A1 (0.41) | CNR2CES2CES1NAAAALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| US-8445571-B2 | Processing agent for polyurethane elastomer fibers | TAKEMOTO YUSHI KABUSHIKI KAISHA (JP) | 2013-05-21 | — | — | US | disclosed |
| US-20120004352-A1 | POLYURETHANE ELASTOMER FIBERS AND PROCESSING AGENT AND METHOD THEREFOR | TAKEMOTO YUSHI KABUSHIKI KAISHA (JP) | 2012-01-05 | — | — | US | disclosed |