Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CAPN1 | P07384 | 1/20 | 0.53 |
| ▸ | CAPN2 | P17655 | 1/20 | 0.53 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.51 |
| ▸ | CTSK | P43235 | 2/20 | 0.50 |
| ▸ | SIRT2 | Q8IXJ6 | 5/20 | 0.49 |
| ▸ | SIRT1 | Q96EB6 | 5/20 | 0.49 |
| ▸ | CTSL | P07711 | 2/20 | 0.49 |
| ▸ | CTSS | P25774 | 2/20 | 0.49 |
| ▸ | TPSAB1 | Q15661 | 2/20 | 0.49 |
| ▸ | PLG | P00747 | 1/20 | 0.49 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.49 |
| ▸ | CTSB | P07858 | 1/20 | 0.47 |
| ▸ | SIRT3 | Q9NTG7 | 3/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL8199768 | 0.87 | CTSL (0.66) | CAPN1CAPN2CTSKSIRT2SIRT1 | |
| SCHEMBL6621545 | 0.87 | HTT (0.60) | — | |
| SCHEMBL8750916 | 0.87 | CTSL (0.62) | CAPN1CAPN2CTSKSIRT2SIRT1 | |
| SCHEMBL9136357 | 0.84 | CTSK (0.62) | CYP1A2CTSKCTSLCTSSTPSAB1 | |
| SCHEMBL12525642 | 0.84 | CAPN1 (0.46) | CAPN1CAPN2SIRT2SIRT1CTSL | |
| SCHEMBL20542840 | 0.84 | SIRT2 (0.60) | SIRT2SIRT1SIRT3 | |
| SCHEMBL20542838 | 0.84 | SIRT2 (0.60) | SIRT2SIRT1SIRT3 | |
| SCHEMBL10481494 | 0.84 | SIRT2 (0.60) | SIRT2SIRT1SIRT3 | |
| SCHEMBL12294550 | 0.83 | CYP2D6 (0.62) | CAPN1CAPN2CYP1A2CTSKTPSAB1 | |
| SCHEMBL10957418 | 0.83 | CYP1A2 (0.58) | CAPN1CAPN2CYP1A2CTSKCTSL |
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 |
|---|---|---|---|---|---|---|---|
| US-6090786-A | HALOPYRROLE AMIDATED AMINO ACID USEFUL FOR INHIBITING SERINE PROTEASE ACTIVITY | FONDATECH BENELUX N.V. (BE) | 2000-07-18 | — | — | US | disclosed |
| EP-0764151-A2 | PURIFICATION OF SERINE PROTEASE AND SYNTHETIC INHIBITORS THEREOF | UNIVERSITAIRE INSTELLING ANTWERPEN (BE) | 1997-03-26 | — | — | EP | disclosed |
| WO-1995034538-A2 | PURIFICATION OF SERINE PROTEASES AND SYNTHETIC INHIBITORS THEREOF | UNIVERSITAIRE INSTELLING ANTWERPEN (BE) | 1995-12-21 | — | — | WO | disclosed |