Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GSTP1 | P09211 | 1/20 | 0.36 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.34 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.34 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.34 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.34 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.34 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.34 |
| ▸ | DHFR | P00374 | 1/20 | 0.33 |
| ▸ | MET | P08581 | 1/20 | 0.32 |
| ▸ | HSD17B1 | P14061 | 1/20 | 0.31 |
| ▸ | HSD17B2 | P37059 | 1/20 | 0.31 |
| ▸ | AKT1 | P31749 | 1/20 | 0.31 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.31 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.31 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.30 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.30 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.30 |
| ▸ | HPGD | P15428 | 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL3199201 | 0.99 | GSTP1 (0.35) | GSTP1SLC6A2SLC6A4SLC6A3HDAC4 | |
| SCHEMBL28941567 | 0.86 | GSTP1 (0.38) | GSTP1SLC6A2SLC6A4SLC6A3HDAC4 | |
| SCHEMBL7601711 | 0.85 | GSTP1 (0.37) | GSTP1SLC6A2SLC6A4SLC6A3HDAC4 | |
| SCHEMBL31425741 | 0.84 | BRD4 (0.32) | CHRNB2CHRNA4 | |
| SCHEMBL2152789 | 0.84 | BRD4 (0.32) | CHRNB2CHRNA4 | |
| Hydrochloric Acid SCHEMBL6322083 | 0.84 | — | — | |
| SCHEMBL3123856 | 0.83 | SLC9A1 (0.32) | METADORA1 | |
| Hydrochloric Acid SCHEMBL3202654 | 0.83 | BRD4 (0.31) | CHRNB2CHRNA4 | |
| SCHEMBL4659071 | 0.83 | EDNRB (0.30) | — | |
| SCHEMBL6055431 | 0.82 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-1953185-B1 | METHOD FOR PRODUCING THERMOPLASTIC RESIN COMPOSITION | MITSUI CHEMICALS INC (JP) | 2011-01-05 | — | — | EP | disclosed |
| EP-1953185-A1 | METHOD FOR PRODUCING THERMOPLASTIC RESIN COMPOSITION | Mitsui Chemicals, Inc. (JP) | 2008-08-06 | — | — | EP | disclosed |