Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSL | P07711 | 2/20 | 0.42 |
| ▸ | CTSB | P07858 | 1/20 | 0.42 |
| ▸ | CTSS | P25774 | 1/20 | 0.42 |
| ▸ | CTSK | P43235 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | CTRB1 | P17538 | 5/20 | 0.41 |
| ▸ | HPGDS | O60760 | 1/20 | 0.41 |
| ▸ | ACE | P12821 | 1/20 | 0.40 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.40 |
| ▸ | CA1 | P00915 | 1/20 | 0.40 |
| ▸ | CA2 | P00918 | 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 | |
|---|---|---|---|---|
| SCHEMBL5371067 | 0.94 | NPC1 (0.42) | CTSLNPC1RAB9ACTRB1HPGDS | |
| SCHEMBL1624127 | 0.83 | SMYD3 (0.42) | NPC1RAB9A | |
| SCHEMBL1624124 | 0.83 | SMYD3 (0.42) | NPC1RAB9A | |
| SCHEMBL5368815 | 0.82 | CA2 (0.41) | CTSLCA1CA2 | |
| SCHEMBL5368051 | 0.82 | NPC1 (0.45) | NPC1RAB9ACA2 | |
| SCHEMBL5363812 | 0.82 | KMT2A (0.46) | CTSLCTSBCTSSCTRB1ACE | |
| SCHEMBL5370680 | 0.81 | KMT2A (0.44) | NPC1RAB9ACTRB1 | |
| SCHEMBL5375114 | 0.80 | KMT2A (0.42) | — | |
| SCHEMBL6369980 | 0.78 | PARP1 (0.40) | — | |
| SCHEMBL5359885 | 0.77 | SMYD3 (0.37) | CTSLACECA1CA2 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7259157-B2 | N-substituted nonaryl-heterocyclo amidyl NMDA/NR2B Antagonists | MERCK & CO., INC. (US) | 2007-08-21 | — | — | US | disclosed |