Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DGAT1 | O75907 | 1/20 | 0.42 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.38 |
| ▸ | PARP1 | P09874 | 2/20 | 0.37 |
| ▸ | ERN1 | O75460 | 3/20 | 0.37 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.37 |
| ▸ | CES2 | O00748 | 3/20 | 0.35 |
| ▸ | CES1 | P23141 | 3/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.35 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.35 |
| ▸ | MAP2K2 | P36507 | 1/20 | 0.34 |
| ▸ | MAP2K1 | Q02750 | 1/20 | 0.34 |
| ▸ | ALB | P02768 | 1/20 | 0.32 |
| ▸ | HSD17B1 | P14061 | 2/20 | 0.32 |
| ▸ | HSD17B2 | P37059 | 2/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL30995317 | 1.00 | DGAT1 (0.42) | DGAT1PTPN11PARP1ERN1ROCK2 | |
| Hydrochloric Acid SCHEMBL30995407 | 0.98 | DGAT1 (0.41) | DGAT1PTPN11PARP1ERN1ROCK2 | |
| Formic Acid SCHEMBL30995428 | 0.94 | ERN1 (0.41) | DGAT1PTPN11PARP1ERN1ROCK2 | |
| Trifluoroacetic Acid SCHEMBL30995388 | 0.89 | L3MBTL1 (0.38) | DGAT1PTPN11PARP1ERN1ROCK2 | |
| Trifluoroacetic Acid SCHEMBL30995384 | 0.89 | L3MBTL1 (0.38) | DGAT1PTPN11PARP1ERN1ROCK2 | |
| SCHEMBL7813369 | 0.83 | HSD17B1 (0.44) | DGAT1CES2CES1HSD17B1HSD17B2 | |
| SCHEMBL28085635 | 0.82 | DGAT1 (0.45) | DGAT1PARP1ROCK2CES2CES1 | |
| SCHEMBL829400 | 0.82 | DGAT1 (0.45) | DGAT1PARP1ROCK2CES2CES1 | |
| SCHEMBL8377321 | 0.80 | AKR1C2 (0.48) | PTPN11ERN1CES2CES1KDM4E | |
| SCHEMBL811079 | 0.78 | DGAT1 (0.42) | DGAT1PARP1ROCK2CES2CES1 |
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-5233082-A | Method of making 3-hydroxy-2,4,5-trifluorobenzoic acid | OCCIDENTAL CHEMICAL CORPORATION (US) | 1993-08-03 | — | — | US | disclosed |