Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSS | P25774 | 2/20 | 0.86 |
| ▸ | HTR1A | P08908 | 1/20 | 0.36 |
| ▸ | HTR1D | P28221 | 1/20 | 0.36 |
| ▸ | HTR1F | P30939 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 5/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.34 |
| ▸ | ACHE | P22303 | 1/20 | 0.34 |
| ▸ | S1PR2 | O95136 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.33 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.33 |
| ▸ | BRD4 | O60885 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL2618905 | 1.00 | CTSS (0.86) | CTSSHTR1AHTR1DHTR1FMAPT | |
| SCHEMBL2713563 | 1.00 | CTSS (0.86) | CTSSHTR1AHTR1DHTR1FMAPT | |
| SCHEMBL2710565 | 0.93 | CTSS (1.00) | CTSSMAPTTP53ACHES1PR2 | |
| SCHEMBL31285784 | 0.93 | CTSS (1.00) | CTSSMAPTTP53ACHES1PR2 | |
| SCHEMBL2618738 | 0.93 | CTSS (1.00) | CTSSMAPTTP53ACHES1PR2 | |
| SCHEMBL2618613 | 0.88 | CTSS (1.00) | CTSSHTR1AHTR1DHTR1FMAPT | |
| SCHEMBL2618855 | 0.87 | CTSS (0.91) | CTSSHTR1AMAPTS1PR2 | |
| SCHEMBL2732083 | 0.87 | CTSS (0.91) | CTSSHTR1AMAPTS1PR2 | |
| SCHEMBL2610222 | 0.86 | CTSS (0.85) | CTSSMAPTSMN1; SMN2TP53S1PR2 | |
| SCHEMBL2710859 | 0.85 | CTSS (0.67) | CTSSHTR1AHTR1DHTR1FMAPT |
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 |
|---|---|---|---|---|---|---|---|
| EP-2630141-A1 | CATHEPSIN S INHIBITOR COMPOUNDS | Eli Lilly and Company (US) | 2013-08-28 | — | — | EP | disclosed |
| WO-2012054315-A1 | CATHEPSIN S INHIBITOR COMPOUNDS | ELI LILLY AND COMPANY (US) | 2012-04-26 | — | — | WO | disclosed |