Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.51 |
| ▸ | JAK2 | O60674 | 1/20 | 0.51 |
| ▸ | RAB9A | P51151 | 1/20 | 0.51 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.51 |
| ▸ | CHRM2 | P08172 | 2/20 | 0.48 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.48 |
| ▸ | CHRM3 | P20309 | 2/20 | 0.48 |
| ▸ | TP53 | P04637 | 2/20 | 0.48 |
| ▸ | OPRM1 | P35372 | 3/20 | 0.45 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | ACHE | P22303 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 3/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | TACR1 | P25103 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL7282542 | 0.85 | SIGMAR1 (0.58) | NPC1JAK2RAB9APAX8CHRM2 | |
| SCHEMBL7440844 | 0.82 | MEN1 (0.41) | NPC1RAB9APAX8CHRM2CHRM1 | |
| SCHEMBL7657782 | 0.80 | DRD4 (0.67) | NPC1JAK2RAB9APAX8OPRM1 | |
| SCHEMBL7434249 | 0.78 | DRD4 (0.61) | — | |
| SCHEMBL19049114 | 0.76 | NPC1 (0.67) | NPC1JAK2RAB9APAX8CHRM2 | |
| SCHEMBL28988920 | 0.75 | CHRM2 (0.50) | NPC1JAK2RAB9APAX8CHRM2 | |
| SCHEMBL5146617 | 0.74 | NPC1 (0.65) | NPC1JAK2RAB9APAX8CHRM2 | |
| SCHEMBL5143727 | 0.74 | NPC1 (0.65) | NPC1JAK2RAB9APAX8CHRM2 | |
| SCHEMBL3772286 | 0.74 | TP53 (0.83) | NPC1JAK2RAB9APAX8TP53 | |
| SCHEMBL2069520 | 0.73 | TP53 (0.70) | NPC1JAK2RAB9APAX8TP53 |
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 |
|---|---|---|---|---|---|---|---|
| US-4499100-A | CARDIOUVASCULAR DISORDERS | SYNTEX (U.S.A.) INC. (US) | 1985-02-12 | — | — | US | disclosed |