Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CLK2 | P49760 | 1/20 | 0.42 |
| ▸ | CLK3 | P49761 | 1/20 | 0.42 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.42 |
| ▸ | ROCK2 | O75116 | 6/20 | 0.40 |
| ▸ | TMPRSS2 | O15393 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 4/20 | 0.38 |
| ▸ | NPC1 | O15118 | 3/20 | 0.38 |
| ▸ | DRD2 | P14416 | 1/20 | 0.38 |
| ▸ | DRD3 | P35462 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | MAOA | P21397 | 1/20 | 0.38 |
| ▸ | MAOB | P27338 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL3440779 | 0.81 | CLK2 (0.42) | CLK2CLK3DYRK1AROCK2TMPRSS2 | |
| SCHEMBL8127319 | 0.78 | CLK2 (0.45) | CLK2CLK3DYRK1AROCK2TMPRSS2 | |
| SCHEMBL3652815 | 0.78 | NPC1 (0.49) | CLK2CLK3DYRK1ATMPRSS2RAB9A | |
| SCHEMBL20119168 | 0.77 | TMPRSS2 (0.50) | CLK2CLK3DYRK1AROCK2TMPRSS2 | |
| SCHEMBL8132355 | 0.75 | PSMB8 (0.46) | CLK2CLK3DYRK1AROCK2RAB9A | |
| SCHEMBL20119296 | 0.74 | KCNA1 (0.49) | ROCK2RAB9ANPC1DRD2DRD3 | |
| SCHEMBL4751055 | 0.74 | ALDH1A1 (0.45) | ROCK2TMPRSS2RAB9ANPC1CYP3A4 | |
| SCHEMBL13012381 | 0.74 | HPGD (0.44) | RAB9ANPC1DRD2DRD3CYP3A4 | |
| SCHEMBL2248318 | 0.74 | ACLY (0.53) | ROCK2RAB9ANPC1CYP3A4ALDH1A1 | |
| SCHEMBL13347344 | 0.74 | ALDH1A1 (0.50) | TMPRSS2RAB9ANPC1CYP3A4ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2008135525-A2 | SUBSTITUTED AZETIDINES, MANUFACTURING AND USE THEREOF AS MEDICAMENTS | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2008-11-13 | — | — | WO | disclosed |
| WO-2008135525-A2 | SUBSTITUTED AZETIDINES, MANUFACTURING AND USE THEREOF AS MEDICAMENTS | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2008-11-13 | — | — | WO | disclosed |