Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | CTSK | P43235 | 4/20 | 0.41 |
| ▸ | CTSS | P25774 | 3/20 | 0.41 |
| ▸ | CTSL | P07711 | 1/20 | 0.41 |
| ▸ | CTSB | P07858 | 1/20 | 0.41 |
| ▸ | PPARA | Q07869 | 5/20 | 0.39 |
| ▸ | PPARG | P37231 | 4/20 | 0.38 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.38 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.38 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.38 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.38 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | CAPN1 | P07384 | 1/20 | 0.36 |
| ▸ | ACE | P12821 | 1/20 | 0.36 |
| ▸ | CA1 | P00915 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL21446926 | 0.88 | CTSK (0.47) | CYP2D6CTSKCTSSCTSLCTSB | |
| SCHEMBL6701850 | 0.86 | FOLH1 (0.44) | CYP2D6SMN1; SMN2CTSKCTSSCTSL | |
| SCHEMBL343678 | 0.84 | CYP2D6 (0.55) | CYP2D6CTSKCTSSCTSLCTSB | |
| SCHEMBL343679 | 0.84 | CYP2D6 (0.55) | CYP2D6CTSKCTSSCTSLCTSB | |
| SCHEMBL3682214 | 0.84 | CYP2D6 (0.55) | CYP2D6CTSKCTSSCTSLCTSB | |
| SCHEMBL6763914 | 0.81 | SMN1; SMN2 (0.53) | SMN1; SMN2CA2ITGB3ITGAV | |
| SCHEMBL14542733 | 0.80 | GRN (0.49) | SMN1; SMN2CTSKCTSSCTSLCTSB | |
| SCHEMBL12513814 | 0.80 | GRN (0.49) | SMN1; SMN2CTSKCTSSCTSLCTSB | |
| SCHEMBL5832014 | 0.80 | SMN1; SMN2 (0.49) | CYP2D6SMN1; SMN2HDAC3HDAC1HDAC2 | |
| SCHEMBL4364211 | 0.80 | CTSK (0.45) | CYP2D6CTSKCTSSCYP1A2CYP2C9 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6723710-B2 | BORON GROUP-SUBSTITUTED ACYCLIC ALPHA AMINO ACIDS ARE USEFUL FOR INHIBITING A VARIETY OF ARINASE- AND NO SYNTHASE-RELATED DISORDERS, INCLUDING HEART DISEASE, GASTROINTESTINAL MOTILITY DISORDERS, AND PENILE ERECTILE DYSFUNCTION IN HUMANS. | THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA | 2004-04-20 | — | — | US | disclosed |
| US-20030036529-A1 | Compositions and methods for inhibiting arginase activity | THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) | 2003-02-20 | — | — | US | disclosed |
| US-6387890-B1 | CARDIOVASCULAR DISORDERS; GASTROINTESTINAL DISORDERS; SEXUAL DISORDERS | TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA | 2002-05-14 | — | — | US | disclosed |
| EP-1049660-A1 | COMPOSITIONS AND METHODS FOR INHIBITING ARGINASE ACTIVITY | THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) | 2000-11-08 | — | — | EP | disclosed |
| WO-1999019295-A1 | COMPOSITIONS AND METHODS FOR INHIBITING ARGINASE ACTIVITY | TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) | 1999-04-22 | — | — | WO | disclosed |