Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.57 |
| ▸ | JAK2 | O60674 | 1/20 | 0.57 |
| ▸ | RAB9A | P51151 | 1/20 | 0.57 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.57 |
| ▸ | NAAA | Q02083 | 4/20 | 0.55 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.53 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.53 |
| ▸ | EPHX1 | P07099 | 3/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.52 |
| ▸ | HTT | P42858 | 1/20 | 0.52 |
| ▸ | LTB4R2 | Q9NPC1 | 1/20 | 0.52 |
| ▸ | EGFR | P00533 | 1/20 | 0.49 |
| ▸ | HPGD | P15428 | 1/20 | 0.48 |
| ▸ | TP53 | P04637 | 1/20 | 0.46 |
| ▸ | ZDHHC2 | Q9UIJ5 | 1/20 | 0.46 |
| ▸ | ASAH1 | Q13510 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL28661257 | 0.94 | NPC1 (0.65) | NPC1JAK2RAB9APAX8NAAA | |
| SCHEMBL28755242 | 0.94 | NPC1 (0.65) | NPC1JAK2RAB9APAX8NAAA | |
| SCHEMBL28673232 | 0.94 | NPC1 (0.65) | NPC1JAK2RAB9APAX8NAAA | |
| SCHEMBL28942086 | 0.94 | NPC1 (0.65) | NPC1JAK2RAB9APAX8NAAA | |
| SCHEMBL28755190 | 0.94 | NPC1 (0.65) | NPC1JAK2RAB9APAX8NAAA | |
| SCHEMBL28666105 | 0.93 | NPC1 (0.62) | NPC1JAK2RAB9APAX8NAAA | |
| SCHEMBL9475341 | 0.88 | HDAC6 (0.62) | NPC1JAK2RAB9APAX8NAAA | |
| SCHEMBL27813286 | 0.88 | TP53 (0.51) | NPC1JAK2RAB9APAX8HDAC1 | |
| SCHEMBL12582517 | 0.86 | LTB4R2 (0.65) | NPC1JAK2RAB9APAX8NAAA | |
| SCHEMBL2085400 | 0.84 | MTNR1A (0.46) | NPC1RAB9APAX8NAAAHDAC1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2006130426-A2 | MODULATORS OF CCR-5 ACTIVITY | KEMIA, INC. (US) | 2006-12-07 | — | — | WO | disclosed |