Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSC | P53634 | 9/20 | 0.37 |
| ▸ | GPBAR1 | Q8TDU6 | 2/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | ERG | P11308 | 1/20 | 0.35 |
| ▸ | CTSK | P43235 | 3/20 | 0.35 |
| ▸ | CTSB | P07858 | 2/20 | 0.35 |
| ▸ | CTSS | P25774 | 2/20 | 0.35 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.35 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.35 |
| ▸ | MCHR1 | Q99705 | 3/20 | 0.34 |
| ▸ | CFD | P00746 | 1/20 | 0.34 |
| ▸ | BCL9 | O00512 | 1/20 | 0.34 |
| ▸ | CTNNB1 | P35222 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL3652410 | 0.92 | CTSC (0.42) | CTSCSLC2A1MCHR1 | |
| SCHEMBL1498887 | 0.86 | CTSC (0.37) | CTSCGPBAR1CYP3A4ERGCTSK | |
| SCHEMBL1498996 | 0.85 | CPT2 (0.36) | CTSCMCHR1 | |
| SCHEMBL3661101 | 0.85 | MGLL (0.36) | MCHR1 | |
| SCHEMBL1499150 | 0.85 | CTSC (0.34) | CTSCCTSKCTSBCTSSSLC2A1 | |
| SCHEMBL1499130 | 0.84 | CPT2 (0.35) | CTSCCTSKCTSBCTSSSLC2A1 | |
| SCHEMBL1499180 | 0.83 | CCR3 (0.35) | CTSC | |
| SCHEMBL1499084 | 0.83 | CTSC (0.37) | CTSCCTSKCTSBCTSSBCL9 | |
| SCHEMBL3656277 | 0.82 | DPP4 (0.38) | CYP3A4MCHR1 | |
| SCHEMBL2072490 | 0.82 | CTSC (0.49) | CTSCCTSKKCNH2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| JP-2011506421-A | — | — | 2011-03-03 | — | — | JP | claimed |
| EP-2231597-A1 | PEPTIDYL NITRILES AND USE THEREOF AS DIPEPTIDYL PEPTIDASE I INHIBITORS | AstraZeneca AB (SE) | 2010-09-29 | — | — | EP | claimed |
| WO-2009074829-A1 | PEPTIDYL NITRILES AND USE THEREOF AS DIPEPTIDYL PEPTIDASE I INHIBITORS | ASTRAZENECA AB (SE) | 2009-06-18 | — | — | WO | claimed |