Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 1/20 | 0.50 |
| ▸ | CA2 | P00918 | 1/20 | 0.50 |
| ▸ | CA7 | P43166 | 1/20 | 0.50 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.49 |
| ▸ | CTSK | P43235 | 12/20 | 0.47 |
| ▸ | CTSS | P25774 | 7/20 | 0.46 |
| ▸ | CTSL | P07711 | 3/20 | 0.44 |
| ▸ | CTSB | P07858 | 2/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL4118840 | 0.84 | CTSK (0.56) | CA1CA2CA7CYP2D6CTSK | |
| SCHEMBL86185 | 0.84 | CTSK (0.56) | CA1CA2CA7CYP2D6CTSK | |
| SCHEMBL30993196 | 0.84 | CA1 (0.49) | CA1CA2CA7CYP2D6CTSK | |
| SCHEMBL30993172 | 0.84 | CA1 (0.49) | CA1CA2CA7CYP2D6CTSK | |
| SCHEMBL86153 | 0.84 | CTSK (0.56) | CA1CA2CA7CYP2D6CTSK | |
| SCHEMBL26996492 | 0.82 | CTSK (0.65) | CA1CA2CA7CYP2D6CTSK | |
| SCHEMBL26996553 | 0.82 | CTSK (0.65) | CA1CA2CA7CYP2D6CTSK | |
| SCHEMBL11010156 | 0.82 | CYP2D6 (0.47) | CA1CA2CA7CYP2D6CTSK | |
| SCHEMBL10829328 | 0.80 | CTSK (0.46) | CA1CA2CA7CYP2D6CTSK | |
| SCHEMBL27423748 | 0.80 | CA1 (0.45) | CA1CA2CA7CYP2D6CTSK |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6949679-B1 | Polyamine transport inhibitors | UNIVERSITE LAVAL (CA) | 2005-09-27 | — | — | US | disclosed |
| WO-2000034226-A1 | POLYAMINE TRANSPORT INHIBITORS | UNIVERSITE LAVAL (CA) | 2000-06-15 | — | — | WO | disclosed |
| EP-1003715-A1 | POLYAMINE TRANSPORT INHIBITORS | UNIVERSITE LAVAL (CA) | 2000-05-31 | — | — | EP | disclosed |
| WO-1999054283-A1 | POLYAMINE TRANSPORT INHIBITORS | UNIVERSITE LAVAL (CA) | 1999-10-28 | — | — | WO | disclosed |
| EP-0876327-A2 | POLYAMINE TRANSPORT INHIBITORS | UNIVERSITE LAVAL (CA) | 1998-11-11 | — | — | EP | disclosed |
| WO-1998017623-A2 | POLYAMINE TRANSPORT INHIBITORS | UNIVERSITE LAVAL (US) | 1998-04-30 | — | — | WO | disclosed |