Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GSTP1 | P09211 | 1/20 | 0.34 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.33 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.33 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.33 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.33 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.33 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.33 |
| ▸ | DHFR | P00374 | 1/20 | 0.32 |
| ▸ | MET | P08581 | 1/20 | 0.31 |
| ▸ | CTSD | P07339 | 1/20 | 0.30 |
| ▸ | BACE1 | P56817 | 1/20 | 0.30 |
| ▸ | HSD17B1 | P14061 | 1/20 | 0.30 |
| ▸ | HSD17B2 | P37059 | 1/20 | 0.30 |
| ▸ | AKT1 | P31749 | 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 | |
|---|---|---|---|---|
| SCHEMBL5952835 | 0.88 | GSTP1 (0.37) | GSTP1SLC6A2SLC6A4SLC6A3HDAC4 | |
| SCHEMBL5364589 | 0.85 | PDCD1 (0.30) | — | |
| SCHEMBL7629329 | 0.81 | NPC1 (0.33) | DHFR | |
| Hydrochloric Acid SCHEMBL7629068 | 0.81 | SLC6A2 (0.36) | GSTP1SLC6A2SLC6A4SLC6A3HDAC4 | |
| SCHEMBL3685084 | 0.80 | CYP2A6 (0.34) | GSTP1SLC6A2SLC6A4SLC6A3HDAC4 | |
| SCHEMBL5950174 | 0.80 | NR1H4 (0.31) | — | |
| SCHEMBL27512111 | 0.77 | GSTP1 (0.35) | GSTP1SLC6A2SLC6A4SLC6A3HDAC4 | |
| Hydrochloric Acid SCHEMBL27550862 | 0.77 | GSTP1 (0.36) | GSTP1SLC6A2SLC6A4SLC6A3HDAC4 | |
| SCHEMBL138909 | 0.76 | GSTP1 (0.34) | GSTP1SLC6A2SLC6A4SLC6A3HDAC4 | |
| SCHEMBL7940308 | 0.76 | GSTP1 (0.44) | GSTP1SLC6A2SLC6A4SLC6A3HDAC4 |
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-6417302-B1 | REACTION PRODUCT OF DI(PENTAFLUOROPHENYL) BORINIC ACID AND ORGANOALUMINUM COMPOUND; OLEFIN POLYMERIZATION COORDINATION CATALYSTS | BASELL POLYOLEFINE GMBH (DE) | 2002-07-09 | — | — | US | disclosed |