Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC1A3 | P43003 | 3/20 | 0.32 |
| ▸ | SLC1A2 | P43004 | 3/20 | 0.32 |
| ▸ | SLC1A1 | P43005 | 3/20 | 0.32 |
| ▸ | SHBG | P04278 | 1/20 | 0.31 |
| ▸ | CTSL | P07711 | 1/20 | 0.31 |
| ▸ | CTSB | P07858 | 1/20 | 0.31 |
| ▸ | CTSK | P43235 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| Isopropyl Alcohol SCHEMBL3275667 | 0.83 | SLC1A3 (0.37) | SLC1A3SLC1A2SLC1A1LMNACYP1A2 | |
| SCHEMBL20531 | 0.82 | CTSL (0.38) | SLC1A3SLC1A2SLC1A1CTSLCTSB | |
| SCHEMBL20265985 | 0.80 | LMNA (0.35) | SLC1A3SLC1A2SLC1A1SHBGCTSL | |
| Methyl Alcohol SCHEMBL3273946 | 0.79 | LMNA (0.39) | SLC1A3SLC1A2SLC1A1CTSLCTSB | |
| SCHEMBL23039739 | 0.79 | CTSL (0.41) | SLC1A3SLC1A2SLC1A1CTSLCTSB | |
| SCHEMBL869115 | 0.79 | CTSL (0.41) | SLC1A3SLC1A2SLC1A1CTSLCTSB | |
| SCHEMBL16239892 | 0.79 | CTSL (0.41) | SLC1A3SLC1A2SLC1A1CTSLCTSB | |
| SCHEMBL29142423 | 0.79 | CTSL (0.37) | SLC1A3SLC1A2SLC1A1CTSLCTSB | |
| SCHEMBL379081 | 0.79 | CTSL (0.41) | SLC1A3SLC1A2SLC1A1CTSLCTSB | |
| SCHEMBL29101108 | 0.79 | CTSL (0.41) | SLC1A3SLC1A2SLC1A1CTSLCTSB |
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 |
|---|---|---|---|---|---|---|---|
| CN-103003269-B | Heterocyclic radical benzyl pyrazole replaced and uses thereof | BAYER INTELLECTUAL PROPERTY GMBH (DE) | 2015-11-25 | — | — | CN | disclosed |
| CN-103003269-A | Substituted heterocyclyl benzyl pyrazoles, and use thereof | BAYER IP GMBH | 2013-03-27 | — | — | CN | disclosed |